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PSN Pharmaceutical Technology Co., Ltd

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Profile: PSN Pharmaceutical Technology Co., Ltd is specialized in researching, manufacturing and trading of rare compounds in gram, kilogram and metric tons scale. Our products include 3-amino-5-carboxyphenylboronic acid, 4-acetylaminophenyl boronic acid, 5-acetyl-2-fluorophenylboronic acid, 9-azo-indole-5-boronic acid, 4-benzylthiophenylboronic acid and 4-butylthiophenylboronic acid.

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• 2H-Indol-2-one, 1,3-dihydro-3,3-bis(4-hydroxy-3-methylphenyl)-
IUPAC Name: 3,3-bis(4-hydroxy-3-methylphenyl)-1H-indol-2-one | CAS Registry Number: 47465-97-4
Synonyms: Isatin biscresol, MLS000570994, EINECS 256-318-7, ZINC04951799, BAS 01811883, LS-83763, SMR000187058, 3,3-Bis(3-methyl-4-hydroxyphenyl)indoline-2-on, 1,3-Dihydro-3,3-bis(4-hydroxy-m-tolyl)-2H-indol-2-one, 3,3-Bis-(4-hydroxy-3-methyl-phenyl)-1,3-dihydro-indol-2-one, 3,3-Bis(4-hydroxy-3-methylphenyl)-1,3-dihydro-2H-indol-2-one

Molecular Formula: C22H19NO3Molecular Weight: 345.391160 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: ZEKCYPANSOJWDH-UHFFFAOYSA-N

• 1-methyl-1H-pyrazole-5-boronic acid pinacol ester
IUPAC Name: 1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole | CAS Registry Number: 847818-74-0
Synonyms: 1-Methyl-1H-pyrazole-5-boronic acid pinacol ester, 1-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole, SBB013484, 1-Methyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-pyrazole, 1-Methyl-1H-pyrazole-5-boronic acid, pinacol ester, 1-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole, 1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole, 4,4,5,5-tetramethyl-2-(1-methylpyrazol-5-yl)-1,3,2-dioxaborolane, ZERO/005567, PubChem17398, AC1NKGB7, SureCN332693, AC1Q40EI, CTK6I4068, CBI-BB ZERO/005567, MolPort-000-141-340, WT799, ACT01769, ANW-52111, TD8153

Molecular Formula: C10H17BN2O2Molecular Weight: 208.065180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HLXOVAMYQUFLPE-UHFFFAOYSA-N

• (4,4-Diethoxy-butyl)-dimethyl-amine
IUPAC Name: 4,4-diethoxy-N,N-dimethylbutan-1-amine | CAS Registry Number: 1116-77-4
Synonyms: 4,4-Diethoxy-N,N-dimethyl-1-butanamine, 4,4-Diethoxy-N,N-dimethylbutylamine, 4,4-diethoxy-N,N-dimethylbutan-1-amine, N,N-Dimethyl-4-aminobutanal diethyl acetal, 4-(Dimethylamino)butyraldehyde Diethyl Acetal, 4-(N,N-Dimethylamino)Butanal Diethyl Acetal, PubChem20793, 4-Dimethylaminobutyraldehyde diethylacetal, AC1LC3BP, ACMC-1C8HB, AGN-PC-0D2XPV, KSC174M6H, 647055_ALDRICH, Jsp000876, CTK0H4663, MolPort-003-938-228, ACT04416, 4,4-Diethoxy-N,N-dimethylbutanamine, 4-Dimethylaminobutanal diethyl acetal, ANW-16306

Molecular Formula: C10H23NO2Molecular Weight: 189.295120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QKXMWBLNSPNBEY-UHFFFAOYSA-N

• 1-N-(tert-Butoxycarbonyl)-2-ethyl-piperazine G Y!
IUPAC Name: tert-butyl 2-ethylpiperazine-1-carboxylate | CAS Registry Number: 393781-71-0
Synonyms: 1-Boc-2-ethyl-piperazine, N-Boc-2-ethylpiperazine, 1-Boc-2-Ethylpiperazine, tert-butyl 2-ethylpiperazine-1-carboxylate, 1-N-BOC-2-ETHYLPIPERAZINE, 1-N-(TERT-BUTOXYCARBONYL)-2-ETHYL-PIPERAZINE, AG-F-39143, (S)-1-Boc-2-ethyl-piperazine, PubChem18360, SureCN336577, AGN-PC-01LR74, CTK4I1302, MolPort-003-985-761, N-1-BOC-2-ETHYL-PIPERAZINE, ANW-50318, RW2925, AKOS005258567, PB18595, QC-1957, RP26829

Molecular Formula: C11H22N2O2Molecular Weight: 214.304580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CTCGRXDGXGUOTE-UHFFFAOYSA-N

• 1-Boc-pyrrolidine-3-carboxylic acid
IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid | CAS Registry Number: 59378-75-5
Synonyms: Ambad28, TL8003786

Molecular Formula: C10H17NO4Molecular Weight: 215.246280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HRMRQBJUFWFQLX-UHFFFAOYSA-N

• 3-(Dimethylamino)-1-(5-pyrimidinyl)-2-propen-1-one
IUPAC Name: 3-(dimethylamino)-1-pyrimidin-5-ylprop-2-en-1-one | CAS Registry Number: 641615-34-1
Synonyms: 3-(Dimethylamino)-1-(pyrimidin-5-yl)prop-2-en-1-one, (E)-3-(DIMETHYLAMINO)-1-(PYRIMIDIN-5-YL)PROP-2-EN-1-ONE, SureCN2571148, CTK5C0845, ANW-64516, AG-G-40497, KB-233558, 2-Propen-1-one,3-(dimethylamino)-1-(5-pyrimidinyl)-

Molecular Formula: C9H11N3OMolecular Weight: 177.203140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: GNNGOBBGXHJRBH-UHFFFAOYSA-N

• (S)-N-Boc-pyrrolidine-3-carboxylic acid
IUPAC Name: (3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid | CAS Registry Number: 140148-70-5
Synonyms: (S)-1-Boc-pyrrolidine-3-carboxylic acid, (s)-1-n-boc-beta-proline, (s)-n-boc-pyrrolidine-3-carboxylic acid, (3s)-boc-beta-pro-oh, (3s)-1-boc-pyrrolidine-3-carboxylic acid, (s)-1-(tert-butoxycarbonyl)pyrrolidine-3-carboxylic acid, S-1-BOC-Pyrrolidine-3-carboxylic acid, (3S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinecarboxylic acid, boc-(3s)-1-pyrrolidine-3-carboxylic acid, (s)-1-n-boc-pyrrolidine-3-carboxylic acid, (3s)-1-(tert-butoxycarbonyl)pyrrolidine-3-carboxylic acid, (s)-pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester, N-BOC-D-BETA-PROLINE, N-BOC-L-BETA-PROLINE, AC1LTQ8Q, SureCN43728, (S)-1-N-Boc-A-proline, KSC883K9L, Jsp002389, CTK7I3595

Molecular Formula: C10H17NO4Molecular Weight: 215.246280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HRMRQBJUFWFQLX-ZETCQYMHSA-N

• 1-Boc-2-Piperidone
IUPAC Name: tert-butyl 2-oxopiperidine-1-carboxylate | CAS Registry Number: 85908-96-9
Synonyms: ZINC05240121, ALBB-009361, CID7577838, tert-butyl 2-oxopiperidine-1-carboxylate, TL8005597, 1,1-Dimethylethyl 2-oxopiperidine-1-carboxylate

Molecular Formula: C10H17NO3Molecular Weight: 199.246880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ULMHMJAEGZPQRY-UHFFFAOYSA-N

• (S)-1-Boc-2-isobutyl-piperazine
IUPAC Name: tert-butyl (2S)-2-(2-methylpropyl)piperazine-1-carboxylate | CAS Registry Number: 674792-06-4
Synonyms: N1-Boc-2-isobutylpiperazine, TL8004756, C-1122

Molecular Formula: C13H26N2O2Molecular Weight: 242.357740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WXGGVOBNOVOVAM-NSHDSACASA-N

• (S)-1-Boc-3-((dimethylamino)methyl)pyrrolidine
IUPAC Name: tert-butyl (3S)-3-[(dimethylamino)methyl]pyrrolidine-1-carboxylate | CAS Registry Number: 859213-51-7
Synonyms: AG-H-46544, PubChem18356, SureCN3564630, CTK5F5979, MolPort-000-140-600, AKOS015836448, AC-1791, RP05474, AK-30141, KB-05686, S917, AB1005737, TL8005599, FT-0084104, FT-0601700, FT-0654882, A841495, I14-3970, (3S)-1-(tert-Butoxycarbonyl)-3-((dimethylamino)methyl)pyrrolidine, (S)-tert-butyl 3-((dimethylamino)methyl)pyrrolidine-1-carboxylate

Molecular Formula: C12H24N2O2Molecular Weight: 228.331160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SVFCKPUIJBZBQS-JTQLQIEISA-N

• (R)-1-Boc-pyrrolidine-1,3-dicarboxylate
IUPAC Name: 1-O-tert-butyl 3-O-methyl (3R)-pyrrolidine-1,3-dicarboxylate | CAS Registry Number: 441717-40-4
Synonyms: (R)-1-tert-butyl 3-methyl pyrrolidine-1,3-dicarboxylate, Methyl1-Boc-3-pyrrolidinecarboxylate, (R)-1-Boc-pyrrolidine-3-carboxylic acid methyl ester, O1-tert-Butyl O3-methyl (3R)-pyrrolidine-1,3-dicarboxylate, (R)-1-tert-Butoxycarbonyl-pyrrolidine-3-carboxylic acid methyl ester, Pyrrolidine-1,3-dicarboxylic acid-1-tert-butyl ester 3-methyl ester, AC1LTTCX, PubChem18386, SureCN1968331, BOCCHEM PS-L-A086, MolPort-003-981-804, ZINC01436156, AKOS015851027, AKOS015911010, AC-1504, PB19062, RP07460, AK-29254, AB1005742, AM20100145

Molecular Formula: C11H19NO4Molecular Weight: 229.272860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: LIWFYAVKYUQMRE-MRVPVSSYSA-N

• (R)-2-Boc-amino-butane-1,4-diol
IUPAC Name: tert-butyl N-[(2R)-1,4-dihydroxybutan-2-yl]carbamate | CAS Registry Number: 397246-14-9
Synonyms: (R)-(+)-2-(Boc-Amino)-1,4-butanediol, (R)-2-Boc-Amino-Butane-1,4-Diol, PubChem15259, KSC498C9F, CTK3J8192, ACN-S003507, ANW-52383, (R)-2-(Boc-amino)-1,4-butanediol, AK-39997, BR-39997, KB-02800, KB-191282, AM20120600, X7004, (R)-2-(BOC-AMINO)-BUTAN-1,4-DIOL, (r)-tert-butyl 1,4-dihydroxybutan-2-ylcarbamate, I14-14059

Molecular Formula: C9H19NO4Molecular Weight: 205.251460 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: KLRRFBSWOIUAHZ-SSDOTTSWSA-N

• 2-Amino-5-bromo-3-(hydroxymethyl)pyridine
IUPAC Name: (2-amino-5-bromopyridin-3-yl)methanol | CAS Registry Number: 335031-01-1
Synonyms: 2-amino-5-bromo-3-(hydroxymethyl)pyridine, (2-amino-5-bromopyridin-3-yl)methanol, 2-Amino-5-bromopyridine-3-methanol, (2-Amino-5-bromo-3-pyridinyl)methanol, (2-Amino-5-bromo-pyridin-3-yl)-methanol, 2-Amino-5-bromo-3-pyridinemethanol, SBB054792, AG-F-13071, (2-amino-5-bromo-3-pyridyl)methan-1-ol, PubChem9344, (2-amino-5-bromo-pyridin-3-yl)methanol, SureCN514211, AC1Q52TH, ACMC-1AD03, KSC496O0R, Jsp006136, CTK3J6708, MolPort-000-001-135, ACN-S002101, ACN-S003487

Molecular Formula: C6H7BrN2OMolecular Weight: 203.036580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HIVQAWXDBPYNDU-UHFFFAOYSA-N

• 1,3-Dibromo-5-Chlorobenzene
IUPAC Name: 1,3-dibromo-5-chlorobenzene | CAS Registry Number: 14862-52-3
Synonyms: 1,3-Dibromo-5-chlorobenzene, 1-Chloro-3,5-dibromobenzene, 129127_ALDRICH, Benzene, 1,3-dibromo-5-chloro-, TPC-I027

Molecular Formula: C6H3Br2ClMolecular Weight: 270.349020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FNKCOUREFBNNHG-UHFFFAOYSA-N

• 3-Pyridinecarbonitrile, 2-(4-methyl-2-phenyl-1-piperazinyl)-
IUPAC Name: 2-(4-methyl-2-phenylpiperazin-1-yl)pyridine-3-carbonitrile | CAS Registry Number: 61337-88-0
Synonyms: SureCN1711576, AKOS000181887, AK-26182, KB-08711, 1-(3-Cyano-2-pyridyl)-4-methyl-2-phenylpiperazine, 1-(3-Cyanopyridyl-2)-2-phenyl-4-methylpiperazine, 2-(4-Methyl-2-phenylpiperazin-1-yl)nicotinonitrile, 2-(4-Methyl-2-phenylpiperazin-1-yl)-3-cyanopyridine, 2-(4-Methyl-2-phenylpiperazin-1-yl)pyridine-3-carbonitrile

Molecular Formula: C17H18N4Molecular Weight: 278.351620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: DHUHYBBSQWQGSN-UHFFFAOYSA-N

• 2-Trifluoromethylpyridine-5-boronic acid
IUPAC Name: [6-(trifluoromethyl)pyridin-3-yl]boronic acid | CAS Registry Number: 868662-36-6
Synonyms: 2-(Trifluoromethyl)pyridine-5-boronic acid, 2-trifluoromethyl-5-pyridineboric acid, 2-(Trifluoromethyl)pyridin-5-ylboronic acid, 6-(trifluoromethyl)pyridin-3-ylboronic acid, 6-(Trifluoromethyl)pyridine-3-boronic acid, 2-TRIFLUOROMETHYL-5-PYRIDINEBORONIC ACID, 2-TRIFLUOROMETHYLPYRIDIN-5-YLBORONIC ACID HCL, PubChem11266, ACMC-209qbx, SureCN249039, CTK5F7298, MolPort-004-968-504, ANW-38395, PC3307, RB2001, SBB091210, AKOS005063811, AB41833, AG-H-50196, LS11104

Molecular Formula: C6H5BF3NO2Molecular Weight: 190.915610 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: BNTIPMNMTIAWIW-UHFFFAOYSA-N

• 1-isocyanocyclohexene
IUPAC Name: 1-isocyanocyclohexene | CAS Registry Number: 1121-57-9
Synonyms: Cyclohexene,1-isocyano-, CTK4A7680, AKOS006293730, AG-D-31098, FT-0649834, I14-32432, 1-Cyclohexen-1-ylisocyanide (7CI,8CI);1-Cyclohexenyl isocyanide;1-Cyclohexenyl isonitrile;1-Isocyanocyclohexene;

Molecular Formula: C7H9NMolecular Weight: 107.153060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DSPXASHHKFVPCL-UHFFFAOYSA-N

• 1-Piperazinecarboxylic acid, 3-ethyl-, 1,1-dimethylethyl ester, (3S)-
IUPAC Name: tert-butyl (3S)-3-ethylpiperazine-1-carboxylate | CAS Registry Number: 928025-56-3
Synonyms: (S)-tert-butyl 3-ethylpiperazine-1-carboxylate, (S)-1-Boc-3-ethyl-piperazine, (S)-1-Boc-3-Ethylpiperazine, (S)-1-N-Boc-3-ethylpiperazine, AG-H-79903, (S)-3-ETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, tert-butyl (3S)-3-ethylpiperazine-1-carboxylate, SureCN18683, CTK5H1713, MolPort-000-140-579, AKOS005258591, AB42224, RP04923, (S)-4-BOC-2-ETHYL-PIPERAZINE, (3S)-1-BOC-3-ETHYL-PIPERAZINE, AK-29608, KB-63434, S-11, TL8005893, FT-0084001

Molecular Formula: C11H22N2O2Molecular Weight: 214.304580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DXJOJUNLMJMJSN-VIFPVBQESA-N

• 1,3-Dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone
IUPAC Name: 1,3-dimethyl-1,3-diazinan-2-one | CAS Registry Number: 7226-23-5
Synonyms: Dimethylpropyleneurea, DMPU, N,N'-Dimethyltrimethyleneurea, CCRIS 4322, N,N'-Dimethylpropylene urea, 251569_ALDRICH, 41661_FLUKA, EINECS 230-625-6, BRN 0110562, ZINC00157131, 1,3-Dimethyl-2-oxohexahydropyrimidine, Tetrahydro-1,3-dimethyl-2(1H)pyrimidine, 2(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-, Tetrahydro-1,3-dimethyl-1H-pyrimidin-2-one, 1,3-Dimethyltetrahydro-2(1H)-pyrimidinone, 1,3-dimethyltetrahydropyrimidin-2(1H)-one, LS-136022, 2-PYRIMIDONE,TETRAHYDRO,1,3-DIMETHYL, 5-24-01-00197 (Beilstein Handbook Reference), InChI=1/C6H12N2O/c1-7-4-3-5-8(2)6(7)9/h3-5H2,1-2H

Molecular Formula: C6H12N2OMolecular Weight: 128.172280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GUVUOGQBMYCBQP-UHFFFAOYSA-N

• (R)-2-methylpyrrolidine hydrochloride
IUPAC Name: (2R)-2-methylpyrrolidine;hydrochloride | CAS Registry Number: 135324-85-5
Synonyms: (2R)-2-methylpyrrolidine Hydrochloride, (r)-2-methylpyrrolidine hcl, (R)-(-)-2-Methylpyrrolidine HCl, (R)-2-Methylpyrrolidinehydrochloride, (R)-2-Methyl-pyrrolidine hydrochloride, PubChem11117, SureCN238775, KSC495M9F, CTK3J5692, MolPort-002-499-366, ANW-52373, (R)-2-METHYL-PYRROLIDINE HCL, AKOS005146077, AKOS015844405, (r)-2-methyl pyrrolidine hydrochloride, AB29488, AC-6782, AG-A-07273, RP19442, (2R)-2-METHYLPYRROLIDINE, HCL

Molecular Formula: C5H12ClNMolecular Weight: 121.608480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: JNEIFWYJFOEKIM-NUBCRITNSA-N

• 7-Fluoroquinazolin-4-ol
IUPAC Name: 7-fluoro-1H-quinazolin-4-one | CAS Registry Number: 16499-57-3
Synonyms: nchembio866-comp42, 7-Fluoroquinazolin-4(3H)-one, ZINC02548718

Molecular Formula: C8H5FN2OMolecular Weight: 164.136503 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KCORZHJVTZIZFD-UHFFFAOYSA-N

• 1H-Pyrazole-4-Carboxylicacid,1,3-Dimethyl-(9CI)
IUPAC Name: 1,3-dimethylpyrazole-4-carboxylic acid | CAS Registry Number: 78703-53-4
Synonyms: BAS 04879380, ALBB-000137, ZERO/005394, STK292777, 1,3-Dimethyl-1H-pyrazole-4-carboxylic acid, CID1273304

Molecular Formula: C6H8N2O2Molecular Weight: 140.139920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YALJPBXSARRWTA-UHFFFAOYSA-N

• 2,3,5,6-1h,4h-Tetrahydro-8-Trifluormethylquinolizino-(9,9a,1-Gh)coumarin
Synonyms: Coumarin 153, Pilot 495, Coumarin 540a, C 6F, MLS000552671, 546186_ALDRICH, CHEBI:51773, MolPort-000-857-343, NSC338964, AIDS012643, BB_SC-0334, AIDS-012643, CID72652, EINECS 258-600-5, STK386370, ZINC00085514, NSC 338964, BAS 00329572, SMR000146186, 9-(Trifluoromethyl)-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-one

Molecular Formula: C16H14F3NO2Molecular Weight: 309.283070 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: VSSSHNJONFTXHS-UHFFFAOYSA-N

• 1,5-Isoquinolinediol
IUPAC Name: 5-hydroxy-2H-isoquinolin-1-one | CAS Registry Number: 5154-02-9
Synonyms: 1,5-isoquinolinediol, 1,5-Dihydroxyisoquinoline, Lopac-I-138, PARP Inhibitor IV, IQD, I138_SIGMA, Lopac0_000655, MLS000860043, 5-Hydroxy-1(2H)-isoquinolinone, 5-Hydroxy-1(2H)-isoquinoline, NSC65585, CID1340, CHEBI:306035, MolPort-003-941-774, 1(2H)-Isoquinolinone, 5-hydroxy-, IN1292, ZINC08616043, SMP2_000192, 5-Hydroxy-2H-isoquinolin-1-one (DHQ), NCGC00015537-01, NCGC00015537-02

Molecular Formula: C9H7NO2Molecular Weight: 161.157380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LFUJIPVWTMGYDG-UHFFFAOYSA-N

• 2-Amino-4-Chloro-5-Methyl-Benzoic Acid
IUPAC Name: 2-amino-4-chloro-5-methylbenzoic acid | CAS Registry Number: 155184-81-9
Synonyms: 2-AMINO-4-CHLORO-5-METHYLBENZOIC ACID, 2-amino-4-chloro-5-methyl-benzoic Acid, 2-Amino -4-chloro-5-methylbenzoic acid, PubChem15932, ACMC-209dc6, SureCN6584037, 4-Chloro-5-methylanthranilicacid, CTK4C8568, ANW-21556, WTI-10501, AKOS006227701, AG-E-03372, AK135737, KB-68058, Benzoic acid,2-amino-4-chloro-5-methyl-, 2-azanyl-4-chloranyl-5-methyl-benzoic acid, A809619, I14-40951

Molecular Formula: C8H8ClNO2Molecular Weight: 185.607620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: FDCMZVNLUFYRAI-UHFFFAOYSA-N

• 1,3,5-Trimethoxybenzene
IUPAC Name: 1,3,5-trimethoxybenzene | CAS Registry Number: 621-23-8
Synonyms: sym-Trimethoxybenzene, Phloroglucinol trimethyl ether, Benzene, 1,3,5-trimethoxy-, 1,3,5-Trimethyoxybenzene, Spectrum_001404, Spectrum2_000426, Spectrum3_001030, Spectrum4_001163, Spectrum5_001766, NCIOpen2_001419, BSPBio_002819, KBioGR_001765, KBioSS_001884, SPECTRUM231043, SPBio_000412, 138827_ALDRICH, O,O,O-1,3,5-Trimethylresorcinol, EINECS 210-673-4, KBio2_001884, KBio2_004452

Molecular Formula: C9H12O3Molecular Weight: 168.189780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LKUDPHPHKOZXCD-UHFFFAOYSA-N

• 1-Bromo-3-Chloropropane
IUPAC Name: 1-bromo-3-chloropropane | CAS Registry Number: 109-70-6
Synonyms: 3-Bromopropyl chloride, 3-Chloropropyl bromide, Trimethylene chlorobromide, Propane, 1-bromo-3-chloro-, 1,3-Chlorbromopropane, 1-Chloro-3-bromopropane, 3-Bromo-1-chloropropane, 3-Chloro-1-bromopropane, omega-Chlorobromopropane, 1-BROMO-3-CHLOROPROPANE, .omega.-Chlorobromopropane, l-Chloro-3-bromopropane, 1,3-Chbp, Trimethylene bromide chloride, I-BCP, Trimethylene bromochloride, CCRIS 6536, B62404_ALDRICH, HSDB 5394, B9673_SIGMA

Molecular Formula: C3H6BrClMolecular Weight: 157.436740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MFESCIUQSIBMSM-UHFFFAOYSA-N

• 1-Bromo-3,4,5-Trifluorobenzene
IUPAC Name: 1-bromo-2,4,5-trifluorobenzene | CAS Registry Number: 327-52-6
Synonyms: 1-Bromo-2,4,5-trifluorobenzene, Ambap2871, 247979_ALDRICH, Benzene, 1-bromo-2,4,5-trifluoro-, JRD-0168, EINECS 206-318-8, TL8002467, InChI=1/C6H2BrF3/c7-3-1-5(9)6(10)2-4(3)8/h1-2

Molecular Formula: C6H2BrF3Molecular Weight: 210.979290 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DVTULTINXNWGJY-UHFFFAOYSA-N

• 3,5-Di(trifluoromethyl) Acetophenone
IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]ethanone | CAS Registry Number: 30071-93-3
Synonyms: 3,5-Bis(trifluoromethyl)acetophenone, 263362_ALDRICH, 3',5'-Bis(trifluoromethyl)acetophenone, JRD-0037, EINECS 250-023-7, SBB005963, ZINC00163156, TL8002329, 1-[3,5-Bis(trifluoromethyl)phenyl]ethanone, 1-(3,5-Bis(trifluoromethyl)phenyl)ethan-1-one

Molecular Formula: C10H6F6OMolecular Weight: 256.144459 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: MCYCSIKSZLARBD-UHFFFAOYSA-N

• 4-Methoxy-2-nitro-benzaldehyde
IUPAC Name: 4-methoxy-2-nitrobenzaldehyde | CAS Registry Number: 22996-21-0
Synonyms: 4-methoxy-2-nitrobenzaldehyde, 4-Formyl-3-nitroanisole, 2-Formyl-5-methoxynitrobenzene, 2-NITRO-4-METHOXYBENZALDEHYDE, SBB052192, AG-E-66578, NSC617208, PubChem17022, KSC495O7F, AC1L7B04, AC1Q47G7, CTK3J5772, MolPort-001-767-513, ACT03498, ANW-51071, CL8363, WT1239, ZINC01613167, AKOS005257256, AB01428

Molecular Formula: C8H7NO4Molecular Weight: 181.145480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: KLTDQLIGNSBZPO-UHFFFAOYSA-N

• (1-Naphthylmethyl)triphenylphosphonium Chloride
IUPAC Name: naphthalen-1-ylmethyl(triphenyl)phosphanium chloride | CAS Registry Number: 23277-00-1
Synonyms: EINECS 245-548-3, ST5410510, (1-Naphthylmethyl)triphenylphosphonium chloride

Molecular Formula: C29H24ClPMolecular Weight: 438.927621 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MOYSMPXSEXYEJV-UHFFFAOYSA-M

• 1,3-Bis(chloromethyl)-1,1,3,3-tetramethyldisiloxane
IUPAC Name: chloromethyl-[chloromethyl(dimethyl)silyl]oxy-dimethylsilane | CAS Registry Number: 2362-10-9
Synonyms: Bis(chloromethyl)tetramethyldisiloxane, NCIOpen2_006391, 302082_ALDRICH, Tetramethylbis(chloromethyl)disiloxane, NSC96793, EINECS 219-109-1, NSC 96793, NSC103492, 1,3-Bis(chloromethyl)tetramethyldisiloxane, NSC 103492, Tetramethyl-1,3-bis(chloromethyl)disiloxane, AI3-51459, Disiloxane, 1,3-bis(chloromethyl)-1,1,3,3-tetramethyl-

Molecular Formula: C6H16Cl2OSi2Molecular Weight: 231.267640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NBGGEWGFZUDQKZ-UHFFFAOYSA-N

• 5-Cyanothiophene-2-boronic acid
IUPAC Name: (5-cyanothiophen-2-yl)boronic acid | CAS Registry Number: 305832-67-1
Synonyms: C2368G1, TL8007134

Molecular Formula: C5H4BNO2SMolecular Weight: 152.966760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZEOMEPSYIIQIND-UHFFFAOYSA-N

• 5,6-Dichloro-1-ethyl-2-methylbenzimidazole
IUPAC Name: 5,6-dichloro-1-ethyl-2-methylbenzimidazole | CAS Registry Number: 3237-62-5
Synonyms: CBDivE_008738, CID76717, EINECS 221-797-3, ZINC00236070, BAS 00009391, ST5000020, 1-Ethyl-2-methyl-5,6-dichlorobenzimidazole, 5,6-Dichloro-1-ethyl-2-methyl-1H-benzimidazole, 5,6-Dichloro-1-ethyl-2-methyl-1H-benzoimidazole, 1H-Benzimidazole, 5,6-dichloro-1-ethyl-2-methyl-

Molecular Formula: C10H10Cl2N2Molecular Weight: 229.105800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IVVLMQPTQOLYDX-UHFFFAOYSA-N

• 2-Amino-4-trifluoromethylanisole
IUPAC Name: 2-methoxy-5-(trifluoromethyl)aniline | CAS Registry Number: 349-65-5
Synonyms: 336599_ALDRICH, ARONIS010359, 2-Methoxy-5-(trifluoromethyl)aniline, 3-Amino-4-methoxybenzotrifluoride, ZINC00152670, 2-Methoxy-5-trifluoromethylaniline, JRD-1718, CID600637, ST5405112, 6-Methoxy-alpha,alpha,alpha-trifluoro-m-toluidine, InChI=1/C8H8F3NO/c1-13-7-3-2-5(4-6(7)12)8(9,10)11/h2-4H,12H2,1H

Molecular Formula: C8H8F3NOMolecular Weight: 191.150430 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RKUSRLUGUVDNKP-UHFFFAOYSA-N

• 1,3-Dithiane
IUPAC Name: 1,3-dithiane | CAS Registry Number: 505-23-7
Synonyms: m-DITHIANE, 1,3-Dithiacyclohexane, 1,3-dithian, Dithiane-1,3, Dithiane-1,3 [French], CCRIS 6777, 157872_ALDRICH, CHEBI:47845, EINECS 208-006-7, NSC 157830, NSC157830, ZINC03861206, AI3-62288, LS-63109, TL8003353, InChI=1/C4H8S2/c1-2-5-4-6-3-1/h1-4H

Molecular Formula: C4H8S2Molecular Weight: 120.236320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WQADWIOXOXRPLN-UHFFFAOYSA-N

• (R)-(-)-Epichlorohydrin
IUPAC Name: 2-(chloromethyl)oxirane | CAS Registry Number: 51594-55-9
Synonyms: EPICHLOROHYDRIN, Epichlorhydrin, Glycidyl chloride, Epichlorophydrin, 2-(Chloromethyl)oxirane, Chloromethyloxirane, epi-Chlorohydrin, alpha-Epichlorohydrin, Chloropropylene oxide, Chloropropylene, Epichlorhydrine, Epicloridrina, Chloromethyl, Oxirane, (chloromethyl)-, Polidexide, SKEKhG, Epichloorhydrine, Epichlorohydryna, 1-Chloro-2,3-epoxypropane, Glycerol epichlorohydrin

Molecular Formula: C3H5ClOMolecular Weight: 92.524200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BRLQWZUYTZBJKN-UHFFFAOYSA-N

• 1-(2-Hydroxyethyl)-4-methylpiperazine
IUPAC Name: 2-(4-methylpiperazin-1-yl)ethanol | CAS Registry Number: 5464-12-0
Synonyms: 1-[N-Methylpiperazine]ethanol, NSC26888, N-(2-Hydroxyethyl)-N'-methylpiperazine, CID231184, 1-(2-Hydroxyethyl)-4-methyl-piperazine, SL-00104

Molecular Formula: C7H16N2OMolecular Weight: 144.214740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QHTUMQYGZQYEOZ-UHFFFAOYSA-N

• 1-(N-Butyl)piperazine
IUPAC Name: 1-butylpiperazine | CAS Registry Number: 5610-49-1
Synonyms: N-Butylpiperazine, 1-Butylpiperazine, 77887_FLUKA, ALBB-002176, CID424322, NSC163107, SBB005884, TL8003645

Molecular Formula: C8H18N2Molecular Weight: 142.241920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YKSVXVKIYYQWBB-UHFFFAOYSA-N

• 1-Bromo-4-iodobenzene
IUPAC Name: 1-bromo-4-iodobenzene | CAS Registry Number: 589-87-7
Synonyms: p-Bromoiodobenzene, p-Iodobromobenzene, p-Bromophenyl iodide, Benzene, 1-bromo-4-iodo-, 4-BROMOIODOBENZENE, 238090_ALDRICH, NSC8033, NSC 8033, EINECS 209-662-7, BBV-080402, AI3-09032, InChI=1/C6H4BrI/c7-5-1-3-6(8)4-2-5/h1-4

Molecular Formula: C6H4BrIMolecular Weight: 282.904430 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UCCUXODGPMAHRL-UHFFFAOYSA-N

• 1,4-Cyclohexandione
IUPAC Name: cyclohexane-1,4-dione | CAS Registry Number: 637-88-7
Synonyms: 1,4-Cyclohexanedione, TETRAHYDROQUINONE, 1,4-Dioxocyclohexane, Cyclohexane-1,4-dione, 125423_ALDRICH, 29070_FLUKA, CHEBI:28286, NSC7192, NSC 7192, EINECS 211-306-0, c0554, STK335618, ZINC03860985, FR-2390, AI3-22410, TL8004488, C08063, InChI=1/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H

Molecular Formula: C6H8O2Molecular Weight: 112.126520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DCZFGQYXRKMVFG-UHFFFAOYSA-N

• (S)-(+)-Epichlorohydrin
IUPAC Name: (2S)-2-(chloromethyl)oxirane | CAS Registry Number: 67843-74-7
Synonyms: (S)-Epichlorohydrin, (S)-(Chloromethyl)oxirane, 2-(Chloromethyl)oxirane, (S)-()-Epichlorohydrin, CCRIS 6388, oxirane, 2-(chloromethyl)-, (2S)-2-(chloromethyl)oxirane, 540080_ALDRICH, Oxirane, (chloromethyl)-, (S)-, 45327_FLUKA, CHEBI:37145, (S)-()-2-(Chloromethyl)oxirane, BRN 1420784, ZINC01487602, SB 02049, LS-101031, TL8004778, 5-17-01-00021 (Beilstein Handbook Reference), InChI=1/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H, 106-89-8

Molecular Formula: C3H5ClOMolecular Weight: 92.524200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BRLQWZUYTZBJKN-GSVOUGTGSA-N

• (2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid
IUPAC Name: (2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid | CAS Registry Number: 80875-98-5
Synonyms: L-Octahydroindole-2-carboxylic acid, (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylic acid, (2S,3AS,7AS)-2-Carboxyoctahydroindole, (2S,3aS,7aS)-Octahydroindole-2-carboxylic acid, (2S,3aS,7aS)-2-Carboxyperhydroindole, (2S,3AS,7AS)-PERHYDROINDOLE-2-CARBOXYLIC ACID, (2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid, hydroindole, L-Octahydroindole-2-carboxylicacid, Octahydro-indole-2-carboxylic acid, AC1OLREW, PubChem15646, H-OIC-OH, L-OIC-OH, AC1Q71AB, SureCN1414979, KSC448A4B, UNII-9ID44U804I, (2S,3aS,7aS)-2-carboxyocta, CTK3E8040

Molecular Formula: C9H15NO2Molecular Weight: 169.220900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CQYBNXGHMBNGCG-FXQIFTODSA-N

• 1-Bromo-2-butanone
IUPAC Name: 1-bromobutan-2-one | CAS Registry Number: 816-40-0
Synonyms: 1-Bromobutanone, 2-Butanone, 1-bromo-, 1-BROMO-2-BUTANONE, Bromomethyl ethyl ketone, 243299_ALDRICH, EINECS 212-431-3, TL 819, BRN 0741894, ZINC02030997, LS-46645, 4-01-00-03258 (Beilstein Handbook Reference)

Molecular Formula: C4H7BrOMolecular Weight: 151.001780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CCXQVBSQUQCEEO-UHFFFAOYSA-N

• (1S,4S)-(-)-2-(3-Fluorophenyl)-2,5-Diazabicyclo[2.2.1]heptane Hydrobromide
IUPAC Name: (1S,4S)-2-(3-fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane;hydrobromide | CAS Registry Number: 294177-35-8
Synonyms: (1S,4S)-(-)-2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane hydrobromide, 473405_ALDRICH, CTK8E2600

Molecular Formula: C11H14BrFN2Molecular Weight: 273.144663 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JVXIFPJAONRBON-ROLPUNSJSA-N

• (2R,3S,4S,5S)-5-Hydroxy-2,3,4-tris(phenylmethoxy)-5-[(phenylmethoxy)methyl]-cyclohexanone
IUPAC Name: (2R,3S,4S,5S)-5-hydroxy-2,3,4-tris(phenylmethoxy)-5-(phenylmethoxymethyl)cyclohexan-1-one | CAS Registry Number: 115250-38-9
Synonyms: AG-D-36234, (2R,3S,4S,5S)-2,3,4-Tris(benzyloxy)-5-((benzyloxy)methyl)-5-hydroxycyclohexanone, SureCN49399, CTK4A9257, MolPort-019-903-581, Cyclohexanone,5-hydroxy-2,3,4-tris(phenylmethoxy)-5-[(phenylmethoxy)methyl]-, (2R,3S,4S,5S)-, AKOS016011227, AK-55294, QC-10785, KB-206527, FT-0084646, FT-0660305, V0913, 2,3,4-Tris-benzyloxy-5-benzyloxymethyl-5-hydroxy-cyclohexanone, (2R,3S,4S,5S)-2,3,4-tris(benzyloxy)-5-(benzyloxymethyl)-5-hydroxycyclohexanone, Cyclohexanone,5-hydroxy-2,3,4-tris(phenylmethoxy)-5-[(phenylmethoxy)methyl]-, [2R-(2a,3b,4a,5a)]-;(2R,3S,4S,5S)-5-Hydroxy-2,3,4-tris(phenylmethoxy)-5-[(phenylmethoxy)methyl]-cyclohexanone;

Molecular Formula: C35H36O6Molecular Weight: 552.656740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: JWXHKWBUBUUEFP-SNSGHMKVSA-N

• 1,2,3,4-Tetrahydroisoquinoline-3-methanol
IUPAC Name: 1,2,3,4-tetrahydroisoquinolin-3-ylmethanol | CAS Registry Number: 63006-93-9
Synonyms: (1,2,3,4-Tetrahydro-isoquinolin-3-yl)-methanol, AE-641/40197878, 1,2,3,4-tetrahydroisoquinolin-3-ylmethanol, (1,2,3,4-Tetrahydroisoquinolin-3-yl)methanol, 62928-94-3, PubChem5794, AC1MWNWL, ACMC-209err, ChemDiv2_003241, SureCN894207, CHEMBL60068, CHEBI:193679, MolPort-000-006-495, HMS1378D07, DNC012117, AKOS004118030, AG-A-00557, AG-L-66658, MCULE-7680348312, SDCCGMLS-0066261.P001

Molecular Formula: C10H13NOMolecular Weight: 163.216320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZSKDXMLMMQFHGW-UHFFFAOYSA-N

• 2H-Bezofuran-3-one
IUPAC Name: 1-benzofuran-3-one | CAS Registry Number: 71699-34-8
Synonyms: Benzofuran-3(2H)-one, 7169-34-8, 3(2H)-BENZOFURANONE, 3-Coumaranone, 1-Benzofuran-3(2H)-one, Coumaranone, Coumaran-3-one, Benzofuran-3-one, 2,3-Dihydrobenzo[b]furan-3-one, 2-hydrobenzo[b]furan-3-one, SBB056285, 2H-3-Benzofuranone, 1-benzofuran-3-one, PubChem7023, 3-BENZOFURANONE, AC1L2MLQ, SureCN69412, NCIOpen2_003700, 2H-BEZOFURAN-3-ONE, 2H-BENZOFURAN-3-ONE

Molecular Formula: C8H6O2Molecular Weight: 134.132040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MGKPCLNUSDGXGT-UHFFFAOYSA-N

• 1-Methyl-1h-Imidazole-5-Carbonyl Chloride Hydrochloride
IUPAC Name: 3-methylimidazole-4-carbonyl chloride;hydrochloride | CAS Registry Number: 343569-06-2
Synonyms: 1-Methyl-1H-imidazole-5-carbonyl chloride hydrochloride, 3-methylimidazole-4-carbonyl Chloride Hydrochloride, SBB069731, 3-Methyl-3H-Imidazole-4-Carbonyl Chloride Hydrochloride, AC1MCR1Z, CTK1C1872, MolPort-000-142-694, ACT03791, AKOS006229229, AG-A-20459, RP03219, AK116537, BP-10036, KB-12769, FT-0608037, Y8798, 1-METHYLIMIDAZOLE-5-CARBONYL CHLORIDE HCL, A822188, 3-methyl-4-imidazolecarbonyl chloride hydrochloride, I14-7948

Molecular Formula: C5H6Cl2N2OMolecular Weight: 181.019940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IRADJQMSOFSMNS-UHFFFAOYSA-N

• [(1s, 3s, 4s)-4-Amino-3-Hydroxy-5-Phenyl-1-(phenylmethyl)pentyl]-Carbamic Acid 1,1-Dimethylethyl Ester
IUPAC Name: tert-butyl N-[(2S,4S,5S)-5-amino-4-hydroxy-1,6-diphenylhexan-2-yl]carbamate | CAS Registry Number: 144163-85-9
Synonyms: tert-Butyl ((2S,4S,5S)-5-amino-4-hydroxy-1,6-diphenylhexan-2-yl)carbamate, [(1S,3S,4S)-4-Amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]-carbamic acid 1,1-dimethylethyl ester, [(1S,3S,4S)-4-Amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]carbamic acid 1,1-dimethyl ethyl ester, SureCN2059435, CTK7G8934, (2S,3S,5S)-2-AMINO-3-HYDROXY-5-(TERT-BUTYLOXYCARBONYLAMINO)-1,6-DIPHENYLHEXANE, MolPort-005-941-577, tert-butyl N-[(2S,4S,5S)-5-amino-4-hydroxy-1,6-diphenylhexan-2-yl]carbamate, AKOS015841346, AKOS015896454, AG-A-03130, AK-33286, BR-33286, S029, KB-259926, FT-0655390, ST51053285, I06-1914, I14-14293

Molecular Formula: C23H32N2O3Molecular Weight: 384.511780 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UKFHOTNATOJBKZ-ACRUOGEOSA-N


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