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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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• (2R,4S)-4-fluoropyrrolidine-2-carboxylic acid
IUPAC Name: (2R,4S)-4-fluoropyrrolidine-2-carboxylic acid | CAS Registry Number: 131176-02-8
Synonyms: AG-D-63262, D-Proline, 4-fluoro-,(4S)-, 4-Fluoro-pyrrolidine-2-carboxylic acid, AC1ODYYA, trans-4-Fluoro-D-proline, SureCN900297, Jsp001877, CTK4B7124, MolPort-000-140-560, ANW-56554, AKOS005063934, AC-2248, RP20042, AK-29824, KB-01285, U345, TL8000738, FT-0601716, B-1564, I11-0112

Molecular Formula: C5H8FNO2Molecular Weight: 133.120923 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: ZIWHMENIDGOELV-IUYQGCFVSA-N

• (R)-1(-4-Fluorophenyl)ethylamine
IUPAC Name: (1R)-1-(4-fluorophenyl)ethanamine | CAS Registry Number: 374898-01-8
Synonyms: (R)-1-(4-fluorophenyl)ethanamine, (R)-1-(4-Fluorophenyl)ethylamine, (1R)-1-(4-fluorophenyl)ethanamine, AG-F-31806, (1R)-(+)-1-(4-Fluorophenyl)ethylamine, PubChem15219, AC1OCT2K, SureCN516801, CTK4H8283, MolPort-001-771-485, ANW-63131, PC3962, AKOS005063986, AKOS010397807, RL03432, AK-89611, KB-63103, (R)-1-(4-FLUOROPHENYL)-ETHYLAMINE, X4561, Benzenemethanamine,4-fluoro-a-methyl-, (aR)-

Molecular Formula: C8H10FNMolecular Weight: 139.170103 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QGCLEUGNYRXBMZ-ZCFIWIBFSA-N

• [1-(4-chlorophenyl)-1H-1,2,3-triazol-4-yl]methanol
IUPAC Name: [1-(4-chlorophenyl)triazol-4-yl]methanol | CAS Registry Number: 133902-66-6
Synonyms: MLS000696237, ZINC00168973, 4F-329S, CID2763878, SMR000333346

Molecular Formula: C9H8ClN3OMolecular Weight: 209.632320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CAHIFLPAMJOAGI-UHFFFAOYSA-N

• (S)-1-(4-Fluorophenyl)ethanol
IUPAC Name: (1S)-1-(4-fluorophenyl)ethanol | CAS Registry Number: 101219-73-2
Synonyms: (1S)-1-(4-fluorophenyl)ethanol, Benzenemethanol,4-fluoro-a-methyl-, (aS)-, AC1LGWGO, PubChem14247, SureCN502826, CTK3J9613, MolPort-001-771-482, ANW-53185, PC0610, SC1236, ZINC00388213, AG-D-07666, AK-76775, KB-03558, FT-0605285, 3S210903, I01-4530, Benzenemethanol,4-fluoro-a-methyl-, (S)-;(-)-1-(4-Fluorophenyl)ethanol;(-)-1-(p-Fluorophenyl)ethanol;(aS)-4-Fluoro-a-methylbenzenemethanol;S-4-Fluoro-a-methylbenzyl alcohol;

Molecular Formula: C8H9FOMolecular Weight: 140.154863 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PSDSORRYQPTKSV-LURJTMIESA-N

• (S)-1-(4-chlorophenyl)ethanol
IUPAC Name: (1S)-1-(4-chlorophenyl)ethanol | CAS Registry Number: 99528-42-4
Synonyms: (S)-1-(4-Chlorophenyl)ethanol, PubChem14251, AC1OCT1K, SureCN3072654, CTK8B9918, MolPort-011-138-731, (1S)-1-(4-chlorophenyl)ethanol, ANW-63569, SC1278, ZINC00388284, (S)-4-Chloro-|A-methylbenzyl alcohol, AG-I-01915, AK-79216, KB-63406, A11332, I01-4549, (S)-4 inverted exclamation marka-Chloro-1-phenylethanol

Molecular Formula: C8H9ClOMolecular Weight: 156.609460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MVOSNPUNXINWAD-LURJTMIESA-N

• 1-Butylboronic Acid
IUPAC Name: butylboronic acid | CAS Registry Number: 4426-47-5
Synonyms: 1-Butaneboronic acid, Propylboronic acid, BUTYLBORONIC ACID, n-Butylboronic acid, 1-Butyldihydroxyborane, 1-BUTANE BORONIC ACID, 163244_ALDRICH, 19667_FLUKA, EINECS 224-607-7, DB02664, TL8003084, InChI=1/C4H11BO2/c1-2-3-4-5(6)7/h6-7H,2-4H2,1H

Molecular Formula: C4H11BO2Molecular Weight: 101.939940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: QPKFVRWIISEVCW-UHFFFAOYSA-N

• 1,1-Thiocarbonyldiimidazole
IUPAC Name: di(imidazol-1-yl)methanethione | CAS Registry Number: 6160-65-2
Synonyms: Thiocarbonyldiimidazole, Thiocarbonylbisimidazole, 1,1'-Thiocarbonyldiimidazole, N,N'-Thiocarbonyldiimidazole, 156051_ALDRICH, 1,1'-(Thiocarbonyl)diimidazole, 1H-Imidazole, 1,1'-carbonothioylbis-, 88545_FLUKA, 1,1'-Thiocarbonylbis(imidazole), Imidazole, 1,1'-(thiocarbonyl)di-, EINECS 228-183-4, NSC141692, ZINC00156304, AI3-62351, ST5308617, TL8003902, 1-(1H-Imidazol-1-ylcarbothioyl)-1H-imidazole

Molecular Formula: C7H6N4SMolecular Weight: 178.214340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RAFNCPHFRHZCPS-UHFFFAOYSA-N

• 1-Cyanoethyl-2-Phenylimidazole
IUPAC Name: 3-(2-phenylimidazol-1-yl)propanenitrile | CAS Registry Number: 23996-12-5
Synonyms: ZINC02508142, CID90325, EINECS 245-972-9, SDCCGMLS-0066172.P001, 2-Phenyl-1H-imidazole-1-propiononitrile, 1H-Imidazole-1-propanenitrile, 2-phenyl-, 145150-83-0, 83930-92-1

Molecular Formula: C12H11N3Molecular Weight: 197.235840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BVYPJEBKDLFIDL-UHFFFAOYSA-N

• (S)-(-)-3-Pyrrolidinol
IUPAC Name: (3S)-pyrrolidin-1-ium-3-ol | CAS Registry Number: 100243-39-8
Synonyms: ZINC01574930, ZINC02140994, CID7003742

Molecular Formula: C4H10NO+Molecular Weight: 88.128300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: JHHZLHWJQPUNKB-BYPYZUCNSA-O

• 1-ao-2-methylindoline
IUPAC Name: 2-methyl-2,3-dihydroindol-1-amine;hydrochloride | CAS Registry Number: 102789-79-7
Synonyms: 1-Amino-2-methylindoline hydrochloride, 1-Amino-2-methylindoline HCl, 2-methyl-2,3-dihydroindol-1-amine Hydrochloride, SBB067188, 2-methylindolin-1-amine hydrochloride, PubChem9485, AC1MC7KV, ACMC-1C5NY, SureCN9697361, Jsp000307, CTK0H4591, MolPort-001-759-330, ANW-60591, AKOS015902811, AG-D-12644, 1-Amino-2-methyl indoline hydrochloride, AK-89629, K922, KB-11096, TL8000132

Molecular Formula: C9H13ClN2Molecular Weight: 184.665920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: RITRKULRSHGFQQ-UHFFFAOYSA-N

• 4-Nitrobenzyl-(1R,5R,6S)-6-[(1R)-1-hydroxyethyl]-2-[(diphenylphosphono)oxy]-1-methylcarbapen-2-em-3-carboxylic acid
IUPAC Name: (4-nitrophenyl)methyl (4R,5R,6S)-3-diphenoxyphosphoryloxy-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate | CAS Registry Number: 90776-59-3
Synonyms: beta-Methyl vinyl phosphate, 3-(Diphenoxy-phosphoryloxy)-6-(1-hy, PubChem15682, SureCN337697, c acid 4-nitro-benzyl ester, MolPort-003-987-420, ACT02863, AC-375, AKOS015919508, BD23080, droxy-ethyl)-4-methyl-7-oxo-1-aza-b, RP17792, icyclo[3.2.0]hept-2-ene-2-carboxyli, AK-49159, BR-49159, TL8005826, FT-0642185, (4R,5R,6S)-3-[(Diphenoxyphosphinyl)oxy]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic Acid (4-Nitrophenyl)methyl Ester, 1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-[(diphenoxyphosphinyl)oxy]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-, (4-nitrophenyl)methyl ester, (4R,5R,6S)-, 4-NITROBENZYL (4R,5S,6S)-3-(DIPHENYLOXY)PHOSPHORYLOXY-6-[(1R)-1-HYDROXYETHYL]-4-METHYL-7-OXO-1-AZABICYCLO[3,2,0]HEPT-2-ENE-2-CARBOXYLATE

Molecular Formula: C29H27N2O10PMolecular Weight: 594.505842 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 10

InChIKey: STULDTCHQXVRIX-PIYXRGFCSA-N

• 4-Chloro-2-fluorobenzotrifluoride
IUPAC Name: 4-chloro-2-fluoro-1-(trifluoromethyl)benzene | CAS Registry Number: 94444-59-4
Synonyms: 4-chloro-2-fluoro-1-(trifluoromethyl)benzene, Benzene, 4-chloro-2-fluoro-1-(trifluoromethyl)-, PubChem1647, SureCN3919252, AGN-PC-000RQ4, MolPort-001-772-757, SBB092366, ZINC55161541, AKOS015890019, AC-4127, AM62153, AS01744, QC-7654, RP25629, AK-53818, KB-37735, U002, FT-0642276, ST51051930, A844959

Molecular Formula: C7H3ClF4Molecular Weight: 198.545333 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VRVYSPQZUGVNKJ-UHFFFAOYSA-N

• (R)-(-)-Ethyl nipecotate
IUPAC Name: ethyl (3R)-piperidine-3-carboxylate | CAS Registry Number: 25137-01-3

Molecular Formula: C8H15NO2Molecular Weight: 157.210200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XIWBSOUNZWSFKU-SSDOTTSWSA-N

• 1,2-Difluorobenzene
IUPAC Name: 1,2-difluorobenzene | CAS Registry Number: 367-11-3
Synonyms: o-Difluorobenzene, Benzene, o-difluoro-, 1,2-DIFLUOROBENZENE, Benzene, 1,2-difluoro-, 1,2-Difluorbenzol, ortho-Difluorobenzene, 126152_ALDRICH, 36890_FLUKA, CHEBI:38583, EINECS 206-680-7, NSC 10275, JRD-0336, NSC10275, BRN 1905113, ZINC00164418, AI3-52226, LS-29835, SB 00649, TL8002704, 4-05-00-00637 (Beilstein Handbook Reference)

Molecular Formula: C6H4F2Molecular Weight: 114.092766 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GOYDNIKZWGIXJT-UHFFFAOYSA-N

• (R)-3-Amino-Piperidine dihydrochloride
IUPAC Name: (3R)-piperidin-3-amine;dihydrochloride | CAS Registry Number: 334618-23-4
Synonyms: (R)-3-AMINOPIPERIDINE DIHYDROCHLORIDE, (R)-(-)-3-Aminopiperidine dihydrochloride, (R)-3-Piperidinamine dihydrochloride, (R)-3-Aminopiperidine 2hcl, R-3-Aminopiperidine Dihydrochloride, (R)-(-)-3-Aminopiperidine 2HCl, (r)-piperidin-3-amine dihydrochloride, (3R)-piperidin-3-amine dihydrochloride, (R)-3-AminopiperidineDihydrochloride, PubChem3013, SureCN306090, KSC495Q2L, 15626_ALDRICH, 666297_ALDRICH, 15626_FLUKA, CTK3J5825, MolPort-000-000-370, R-3-AMINO PIPERIDINE DIHCL, ACN-S003802, ACT04891

Molecular Formula: C5H14Cl2N2Molecular Weight: 173.084060 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 2

InChIKey: GGPNYXIOFZLNKW-ZJIMSODOSA-N

• (S)-N-boc-3-Pyrrolidinol
IUPAC Name: tert-butyl (3S)-3-hydroxypyrrolidine-1-carboxylate | CAS Registry Number: 101469-92-5
Synonyms: (S)-1-N-Boc-3-hydroxypyrrolidine, (S)-1-Boc-3-hydroxypyrrolidine, (S)-(+)-1-Boc-3-hydroxypyrrolidine, (S)-(+)-N-Boc-3-pyrrolidinol, (S)-1-Boc-3-pyrrolidinol, s-bochp, (S)-N-Boc-3-pyrrolidinol, (S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinol, (S)-tert-butyl 3-hydroxypyrrolidine-1-carboxylate, tert-butyl (3S)-3-hydroxypyrrolidine-1-carboxylate, (S)-N-tboc-3-pyrrolidinol, (S)-3-hydroxypyrrolidine, n-boc protected, (S)-Boc-3-hydroxypyrrolidine, (S)-(+)-Boc-3-pyrrolidinol, (S)-N-Boc-3-hydroxypyrrolidine, N-boc-(S)-3-hydroxypyrrolidine, n-t-boc-(s)-3-hydroxypyrrolidine, (S)-1-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine, N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol, (3s)-(+)-n-boc-3-hydroxypyrrolidine

Molecular Formula: C9H17NO3Molecular Weight: 187.236180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: APCBTRDHCDOPNY-ZETCQYMHSA-N

• 4-Bromo-2-Thiophenecarboxylic Acid
IUPAC Name: 1-acetyl-2H-indol-3-one | CAS Registry Number: 16800-68-3
Synonyms: 1-Acetyl-3-indolinone, 1-acetylindolin-3-one, 1-Acetyl-1,2-dihydro-3H-indol-3-one, 1-acetyl-3-oxoindoline, 1-acetyl-2H-indol-3-one, 1-Acetyl-1,2-dihydro-indol-3-one, AC1LBN8I, ChemDiv2_000019, AC1Q6K6T, SureCN1048074, ACMC-1CH35, ARONIS24219, CTK4D2840, MolPort-000-690-143, BB_NC-1630, HMS1369A19, ACT03735, ANW-22325, AR-1C1297, BBL011765

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AUMJJQZNOVOCGY-UHFFFAOYSA-N

• (1r)-(s)-Pinanediol 1-Ammonium Trifluoroacetate-3-Methylbutane-1-Boronate
Synonyms: (R)-BoroLeu-(+)-Pinanediol-CF3COOH, (R)-BoroLeu-(+)-Pinanediol-CF3CO2H, (R)-BoroLeu-(+)-Pinanediol trifluoroacetate, PubChem11602, (aR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine 2,2,2-trifluoroacetate, ACT03743, AKOS015896703, AC-2355, RL02289, AK-44948, (R)-BoroLeu-(+)-pinanediol-trifluoroacetate, I06-2263, (1R)-(S)-Pinanediol 1-ammonium trifluoroacetate-3-methylbutane-1-boronate, (1R)-(S)-Pinanediol-1-ammoniumtrifluoroacetate-3-methylbutane-1-boronate, (|AR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetate, (|AR,3aS,4S,6S,7aR)-Hexahydro-3a,5,5-trimethyl-|A-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine 2,2,2-Trifluoroacetate, (1R)-1-[(1S,2S,6R,8S)-1,8-dihydrogenio-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]-3-methylbutan-1-amine; trifluoroacetic acid, (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0?,?]decan-4-yl]butan-1-amine; trifluoroacetic acid, (R)-3-METHYL-1-((3AS,4S,6S,7AR)-3A,5,5-TRIMETHYLHEXAHYDRO-4,6-METHANOBENZO[D][1,3,2]DIOXABOROL-2-YL)BUTAN-1-AMINE 2,2,2-TRIFLUOROACETATE

Molecular Formula: C17H29BF3NO4Molecular Weight: 379.222670 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: SRFQKJZNJYTMNI-CDVUYJLHSA-N

• (-)diisopinocampheyl Borane
IUPAC Name: bis[(1R,3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]boron | CAS Registry Number: 21932-54-7
Synonyms: (-)-Diisopinocampheylborane, Bis((1R,2S,3R,5R)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-yl)borane, PubChem18202, AKOS016010574, AK119649, KB-251043

Molecular Formula: C20H34BMolecular Weight: 285.294960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MPQAQJSAYDDROO-VMAIWCPRSA-N

• 1,2,4-Trimethyl-5-Benzenesulfonic Acid;
IUPAC Name: 2,4,5-trimethylbenzenesulfonic acid | CAS Registry Number: 3453-84-7
Synonyms: NSC163978, CID294870, ST5409442

Molecular Formula: C9H12O3SMolecular Weight: 200.254780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RFDZNGIWELUYOT-UHFFFAOYSA-N

• (s)-2,3-Dihydro-1h-Inden-1-Amine
IUPAC Name: (1S)-2,3-dihydro-1H-inden-1-amine | CAS Registry Number: 61341-86-4
Synonyms: (S)-1-aminoindane, (S)-(+)-1-Aminoindan, (S)-(+)-1-aminoindane, (S)-2,3-dihydro-1H-inden-1-amine, (1S)-2,3-dihydro-1H-inden-1-amine, (S)-(+)-1-Indanamine, AG-G-23415, 1H-Inden-1-amine, 2,3-dihydro-,(1S)-, AC1OCSUY, PubChem12577, (S)-(+)-Indanamine, (1S)INDANYLAMINE, AC1Q4UBU, AC1Q4UBX, S-AI, SureCN42780, (S)-INDAN-1-YLAMINE, (1S)-INDAN-1-AMINE, 445355_ALDRICH, IND058

Molecular Formula: C9H11NMolecular Weight: 133.190340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XJEVHMGJSYVQBQ-VIFPVBQESA-N

• (2s,3ar,7as)-Octahydro-Indole-2-Carboxylic Acid
IUPAC Name: (2S,3aR,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid | CAS Registry Number: 145438-94-4
Synonyms: (2S,3aR,7aS)-Octahydroindole-2-carboxylic acid, (2S,3aR,7aS)-Octahydro-1H-indole-2-carboxylic acid, PubChem15854, SureCN497280, (2S,3AR,7AS)-OCTAHYDRO-INDOLE-2-CARBOXYLIC ACID, IND085, CTK8C1454, MolPort-003-849-653, ANW-66662, FD7165, AKOS006284740, AKOS015854020, AM84415, AK-29867, KB-206591, L-(2S,3aR,7aS)-Octahydroindole-2-carboxylic Acid, 1H-Indole-2-carboxylic acid, octahydro-, (2S,3aR,7aS)-, (2S,3AR,7AS)-OCTAHYDRO-1H- INDOLE-2-CARBOXYLIC ACID, [2S-(2|A,3a|A,7a|A)]-Octahydro-1H-indole-2-carboxylic Acid

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

InChIKey: CQYBNXGHMBNGCG-CSMHCCOUSA-N

• (R)-Piperazine-2-carboxylic acid dihydrochloride
IUPAC Name: (2R)-piperazine-2-carboxylic acid;dihydrochloride | CAS Registry Number: 126330-90-3
Synonyms: (R)-2-Piperazinecarboxylic acid dihydrochloride, (R)-Piperazine-2-carboxylic acid 2HCl, (R)-(+)-2-Piperazinecarboxylic acid dihydrochloride, (R)-(+)-Piperazine-2-carboxylic acid dihydrochloride, 2-(R)-Piperazine carboxylic acid 2HCl, (R)-piperazine-2-carboxylicaciddihydrochloride, SureCN283015, KSC496A5H, Jsp001680, 67176_FLUKA, CTK3J6053, MolPort-000-005-914, BH788, ACN-S002924, ACT02151, ANW-18926, FC0187, AKOS015845424, AC-1211, OR15637

Molecular Formula: C5H12Cl2N2O2Molecular Weight: 203.066980 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 4

InChIKey: WNSDZBQLMGKPQS-RZFWHQLPSA-N

• 4-Aminomethyl-1-N-(t-butoxycarbonyl)piperidine
IUPAC Name: tert-butyl 4-(aminomethyl)piperidine-1-carboxylate | CAS Registry Number: 144222-22-0
Synonyms: 1-Boc-4-(aminomethyl)piperidine, 641472_ALDRICH, ALBB-006247, KM 10802, TL8000969, C-3114, tert-Butyl 4-aminomethylpiperidine-1-carboxylate, tert-butyl 4-(aminomethyl)piperidine-1-carboxylate

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

InChIKey: KLKBCNDBOVRQIJ-UHFFFAOYSA-N

• 1,2,3-Trifluorobenzene
IUPAC Name: 1,2,3-trifluorobenzene | CAS Registry Number: 1489-53-8
Synonyms: 1,2,3-TRIFLUOROBENZENE, Benzene, 1,2,3-trifluoro-, 324752_ALDRICH, JRD-0245, TL806295

Molecular Formula: C6H3F3Molecular Weight: 132.083230 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AJKNNUJQFALRIK-UHFFFAOYSA-N

• (S)-Benzyloxymethyl-oxirane
IUPAC Name: (2S)-2-(phenylmethoxymethyl)oxirane | CAS Registry Number: 16495-13-9
Synonyms: (S)-O-Benzylglycidol, (S)-Benzyl glycidyl ether, (+)-Benzyl glycidyl ether, (S)-(Benzyloxymethyl)oxirane, (+)-(Benzyloxymethyl)oxirane, CCRIS 6386, 363537_ALDRICH, ()-Benzyl (S)-glycidyl ether, (R)-1-(Benzyloxy)-2,3-epoxypropane, (S)-()-2-(Benzyloxymethyl)oxirane, ZINC02170166, NCGC00166091-01, Propane, 1-(benzyloxy)-2,3-epoxy-, (R)-, Oxirane, ((phenylmethoxy)methyl)-, (S)-, LS-119620, Propane, 1-(benzyloxy)-2,3-epoxy-, (S)-, Oxirane, ((phenylmethoxy)methyl)-, (S)- (9CI), Propane, 1-(benzyloxy)-2,3-epoxy-, (S)- (8CI)

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QNYBOILAKBSWFG-SNVBAGLBSA-N

• (1S,2S)-Cyclohexane-1,2-diamine
IUPAC Name: cyclohexane-1,2-diamine | CAS Registry Number: 21436-03-3
Synonyms: 1,2-Cyclohexanediamine, 1,2-Cylohexanediamine, cis-1,2-Cyclohexanediamine, 1,2-DIAMINOCYCLOHEXANE, cis-1,2-Cyclohexandiamine, Cyclohex-1,2-ylenediamine, trans-1,2-Cyclohexanediamine, cyclohexane-1,2-diamine, trans-1,2-Cyclohexaneiamine, HSDB 5748, 132551_ALDRICH, 293962_ALDRICH, (+)-S,S-1,2-Diaminocyclohexane, EINECS 211-776-7, CID4610, (1S,2S)-(+)-1,2-Diaminocyclohexane, (-)-R,R-1,2-Diaminocyclohexane, BRN 0506142, NSC362640, NSC362641

Molecular Formula: C6H14N2Molecular Weight: 114.188760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SSJXIUAHEKJCMH-UHFFFAOYSA-N

• 2,6-Dimethoxy-3-pyridineboronic acid
IUPAC Name: (2,6-dimethoxypyridin-3-yl)boronic acid | CAS Registry Number: 221006-70-8
Synonyms: BM316, 2,6-Dimethoxypyridine-3-boronic acid, ST5408529

Molecular Formula: C7H10BNO4Molecular Weight: 182.969600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ADGHSWFUZUADDH-UHFFFAOYSA-N

• (R)-(+)-alpha, alpha-Diphenyl-2-pyrrolidinemethanol
IUPAC Name: di(phenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanol | CAS Registry Number: 22348-32-9
Synonyms: ZINC03632771

Molecular Formula: C17H20NO+Molecular Weight: 254.346800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: OGCGXUGBDJGFFY-MRXNPFEDSA-O

• (R)-1-N-Boc-piperazine-2-carboxylic acid methyl ester
IUPAC Name: 1-O-tert-butyl 2-O-methyl (2R)-piperazine-1,2-dicarboxylate | CAS Registry Number: 252990-05-9
Synonyms: Methyl (R)-1-Boc-piperazine-2-carboxylate, (R)-N-Boc-piperazine-2-carboxylic acid methyl ester, (R)-Piperazine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester, (r)-1-tert-butyl 2-methyl piperazine-1,2-dicarboxylate, PubChem18319, SureCN6350612, CTK3J6957, MolPort-000-006-040, ACN-S002926, [(2-n-boc)piperazine(2r)cooh]-ome, ANW-47281, ZINC21297746, AKOS005258544, AKOS015897820, AC-2195, AG-C-28342, PB15780, AK-29940, BR-29940, KB-02773

Molecular Formula: C11H20N2O4Molecular Weight: 244.287500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: BRXKHIPPSTYCKO-MRVPVSSYSA-N

• 1,2,3,9-Tetrahydro-9-methyl-4H-carbazole-4-one
IUPAC Name: 9-methyl-2,3-dihydro-1H-carbazol-4-one | CAS Registry Number: 27387-31-1
Synonyms: 1,2,3,4-Tetrahydro-9-methylcarbazol-4-one, 1,2,3,9-TETRAHYDRO-9-METHYL-4H-CARBAZOLE-4-ONE, 9-Methyl-2,3,4,9-tetrahydro-1H-carbazol-4-one, 9-Methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one, 9-methyl-2,3-dihydro-1H-carbazol-4-one, 9-methyl-1,2,3,4-tetrahydro-4-oxocarbazole, 9-Methyl-1,2,3,9-tetrahydro-carbazol-4-one, 9-Methyl-1,2,3,9-tetrahydro-carbazol-4-, 4H-Carbazol-4-one, 1,2,3,9-tetrahydro-9-methyl-, 9-methyl-1,2,3,9-tetrahydro-4aH-carbazol-4-one, ZERO/001167, PubChem9952, AGN-PC-0CUJQD, AC1LCC4S, Maybridge1_001957, SureCN1146660, Ondansetron related compound C, UNII-267IW42T7Z, AC1Q3Z59, Jsp005325

Molecular Formula: C13H13NOMolecular Weight: 199.248420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HHJUJCWZKJMCLC-UHFFFAOYSA-N

• 1,2-Epoxycyclopentane
IUPAC Name: (1R,5S)-6-oxabicyclo[3.1.0]hexane | CAS Registry Number: 285-67-6
Synonyms: 6-Oxabicyclo[3.1.0]hexane, ZINC01639894, ZINC01639895, InChI=1/C5H8O/c1-2-4-5(3-1)6-4/h4-5H,1-3H

Molecular Formula: C5H8OMolecular Weight: 84.116420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GJEZBVHHZQAEDB-SYDPRGILSA-N

• 2-Hydroxymethyl-1,4-benzodioxane
IUPAC Name: 2,3-dihydro-1,4-benzodioxin-2-ylmethanol | CAS Registry Number: 3663-82-9
Synonyms: Maybridge1_002629, ChemDiv2_000056, 1,4-Benzodioxane-2-methanol, 1,4-BENZODIOXAN-2-METHANOL, Oprea1_310698, H38403_ALDRICH, 2-Hydroxymethyl-1,4-benzodioxan, DivK1c_001381, NSC 1880, 2-(Hydroxymethyl)-1,4-benzodioxan, EINECS 222-921-9, NSC1880, NSC 24520, NSC 36118, NSC 36578, NSC 51502, NSC 403800, NSC24520, NSC36118, NSC36578

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GWQOQQVKVOOHTI-UHFFFAOYSA-N

• 2-(4,5-Dichloro-2-nitrophenyl)acetic acid
IUPAC Name: 2-(4,5-dichloro-2-nitrophenyl)acetic acid | CAS Registry Number: 37777-90-5
Synonyms: NSC54852, CID244198, 7T-0205

Molecular Formula: C8H5Cl2NO4Molecular Weight: 250.035600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NIBVBDGBJQMRNF-UHFFFAOYSA-N

• 3'-Fluoroacetophenone
IUPAC Name: 1-(3-fluorophenyl)ethanone | CAS Registry Number: 455-36-7
Synonyms: m-Fluoroacetophenone, Acetophenone, 3'-fluoro-, 3-FLUOROACETOPHENONE, Ethanone, 1-(3-fluorophenyl)-, NCIOpen2_001445, 219347_ALDRICH, JRD-0122, NSC88301, EINECS 207-245-4, ZINC00164731, SB 01647, TL8003164, 3S210963, InChI=1/C8H7FO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H

Molecular Formula: C8H7FOMolecular Weight: 138.138983 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HCEKGPAHZCYRBZ-UHFFFAOYSA-N

• (S)-3-Hydroxypiperidine hydrochloride
IUPAC Name: (3S)-piperidin-3-ol;hydrochloride | CAS Registry Number: 475058-41-4
Synonyms: (S)-3-Hydroxypiperidine HCl, (S)-piperidin-3-ol hydrochloride, (S)-3-Piperidinol hydrochloride, (S)-3-Hydroxypiperidinehydrochloride, (s)-3-hydroxylpiperidine hydrochloride, (s)-(-)-3-hydroxypiperidine hydrochloride, (3S)-Piperidin-3-Ol Hydrochloride, PubChem11309, SureCN16718, KSC491E8T, 30169_ALDRICH, 30169_FLUKA, CTK3J1289, MolPort-000-004-385, ACT02045, ANW-52347, AKOS015848379, AG-A-08314, (3S)-(-)-Piperidin-3-ol hydrochloride, AC-15329

Molecular Formula: C5H12ClNOMolecular Weight: 137.607880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: VLECDMDGMKPUSK-JEDNCBNOSA-N

• 2-Bromo-4-thiazolecarboxylic acid
IUPAC Name: 2-bromo-1,3-thiazole-4-carboxylic acid | CAS Registry Number: 5198-88-9
Synonyms: B2124M500

Molecular Formula: C4H2BrNO2SMolecular Weight: 208.033180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BEGREHRAUWCAHV-UHFFFAOYSA-N

• 1,2,3,4-Tetrafluorobenzene
IUPAC Name: 1,2,3,4-tetrafluorobenzene | CAS Registry Number: 551-62-2
Synonyms: TETRAFLUOROBENZENE, 1,2,3,4-TETRAFLUOROBENZENE, Benzene, 1,2,3,4-tetrafluoro-, T11630_ALDRICH, 2,3,4,5-Tetrafluorobenzene, NSC21635, EINECS 208-997-6, EINECS 248-779-8, TL8003603, 28016-01-5

Molecular Formula: C6H2F4Molecular Weight: 150.073693 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SOZFIIXUNAKEJP-UHFFFAOYSA-N

• 1-Bromo-2-naphthol
IUPAC Name: 1-bromonaphthalen-2-ol | CAS Registry Number: 573-97-7
Synonyms: Disthemin, Wormin, 2-Naphthalenol, 1-bromo-, 1-Bromo-2-naphthalenol, 1-Brom-2-naphthol [German], 2-NAPHTHOL, 1-BROMO-, B73201_ALDRICH, MLS000069595, .alpha.-Bromo-.beta.-naphthol, ARONIS022368, NSC60275, EINECS 209-363-1, NSC 60275, AIDS125054, 2-Naphthalenol, 1-bromo- (9CI), AIDS-125054, BRN 2044001, STK068802, ZINC00001318, LS-95415

Molecular Formula: C10H7BrOMolecular Weight: 223.065980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: FQJZPYXGPYJJIH-UHFFFAOYSA-N

• (R)-4-Glycidyl butyrate
IUPAC Name: [(2R)-oxiran-2-yl]methyl butanoate | CAS Registry Number: 60456-26-0
Synonyms: (R)-Glycidyl butyrate, 338125_ALDRICH, 50038_FLUKA, 92343_FLUKA, ZINC01730609, (R)-(−)-Glycidyl butyrate, SB 01469, TL8003828, (R)-(−)-Oxirane-2-methanol butyrate

Molecular Formula: C7H12O3Molecular Weight: 144.168380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YLNSNVGRSIOCEU-ZCFIWIBFSA-N

• (R)-Methyl glycidyl ether
IUPAC Name: (2R)-2-(methoxymethyl)oxirane | CAS Registry Number: 64491-70-9
Synonyms: 454680_ALDRICH, 50024_FLUKA, ZINC02040167, (R)-(−)-Glycidyl methyl ether, (R)-(−)-Methyl glycidyl ether, (R)-(−)-2-(Methoxymethyl)oxirane

Molecular Formula: C4H8O2Molecular Weight: 88.105120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LKMJVFRMDSNFRT-BYPYZUCNSA-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


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