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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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• 1-Ethyl-7-Nitro-1,2,3,4-Tetrahydroquinoline
IUPAC Name: 1-ethyl-7-nitro-3,4-dihydro-2H-quinoline | CAS Registry Number: 57883-28-0
Synonyms: 1-Ethyl-7-nitro-1,2,3,4-tetrahydroquinoline, N-ETHYL-7-NITRO-1,2,3,4-TETRAHYDROQUINOLINE, 7-Nitro-N-ethyl-1,2,3,4-tetrahydro-quinoline, 1-Ethyl-7-nitro-1,2,3,4-tetrahydro-, PubChem6085, CTK5A7592, MolPort-005-942-221, ANW-52139, SBB067230, ZINC22011245, AKOS005146550, AG-L-23710, RP26232, AK-49019, BR-49019, 1-ethyl-7-nitro-3,4-dihydro-2H-quinoline, KB-152700, FT-0640495, N-Ethyl-7-nitro-1,2,3,4-tetrahydroquinoline;, Quinoline,1-ethyl-1,2,3,4-tetrahydro-7-nitro-

Molecular Formula: C11H14N2O2Molecular Weight: 206.241060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: TUCATNRJGJWEKT-UHFFFAOYSA-N

• 1-[2-(morpholin-4-Ylmethyl)phenyl]methylamine
IUPAC Name: [2-(morpholin-4-ium-4-ylmethyl)phenyl]methylazanium | CAS Registry Number: 91271-82-8
Synonyms: ZINC04206488, CID7129149

Molecular Formula: C12H20N2O+2Molecular Weight: 208.300000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: NMFAEZHWSZZJOA-UHFFFAOYSA-P

• (2-Oxo-Propyl)-Carbamic Acid Tert-Butyl Ester
IUPAC Name: tert-butyl N-(2-oxopropyl)carbamate | CAS Registry Number: 170384-29-9
Synonyms: (2-Oxopropyl)carbamic acid tert-butyl ester, tert-Butyl 2-oxopropylcarbamate, tert-butyl N-(2-oxopropyl)carbamate, NSC617629, (2-Oxo-propyl)-carbamicacidtert-butylester, (2-Oxo-propyl)-carbamic acid tert-butyl ester, AC1L7BKW, AC1Q5XQY, CTK8B5661, MolPort-003-986-514, tert-Butyl (2-oxopropyl)carbamate, ANW-49494, ZINC01613350, AKOS005266530, AM84593, NSC-617629, AK-25487, BR-25487, KB-01246, NCI60_005315

Molecular Formula: C8H15NO3Molecular Weight: 173.209600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OZGMUQGCAFEQOX-UHFFFAOYSA-N

• 1-Methyl-4-Phenylpiperazine
IUPAC Name: 1-methyl-4-phenylpiperazin-1-ium | CAS Registry Number: 3074-43-9
Synonyms: ZINC01634034

Molecular Formula: C11H17N2+Molecular Weight: 177.266080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WQDDXVGJRSTLED-UHFFFAOYSA-O

• 1,3-Dibromo-5,5-dimethylhydantoin
IUPAC Name: 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione | CAS Registry Number: 77-48-5
Synonyms: Dibromantin, Dibromantine, Take Charge Orange, TakeCharge Orange, Ambap4436, N,N'-Dibromodimethylhydantoin, 5,5-Dimethyl-1,3-dibromohydantoin, 157902_ALDRICH, NSC33305, EINECS 201-030-9, CID6479, NSC 33305, AIDS057296, EPA Pesticide Chemical Code 006317, AIDS-057296, BRN 0146024, ZINC01665566, AI3-23671, HYDANTOIN, 1,3-DIBROMO-5,5-DIMETHYL-, 2,4-Imidazolidinedione, 1,3-dibromo-5,5-dimethyl-

Molecular Formula: C5H6Br2N2O2Molecular Weight: 285.921340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VRLDVERQJMEPIF-UHFFFAOYSA-N

• 6-Methyl-3-Oxo-2,3-Dihydropyridazine-4-Carboxylic Acid
IUPAC Name: 3-methyl-6-oxo-1H-pyridazine-5-carboxylic acid | CAS Registry Number: 74557-73-6
Synonyms: 6-Methyl-3-oxo-2,3-dihydropyridazine-4-carboxylic acid, 2,3-Dihydro-6-methyl-3-oxopyridazine-4-carboxylic acid, SBB053235, AG-G-96472, 6-methyl-3-oxo-2-hydropyridazine-4-carboxylic acid, SureCN949563, CTK2H6856, MolPort-000-140-134, ANW-56291, AKOS006346727, MCULE-3845367925, RP01833, AK-24072, KB-87054, FT-0685429, ST50949630, Y9983, C-1872, 4-Carboxy-2,3-dihydro-6-methyl-3-oxopyridazine, 6-methyl-3-oxo-2H-pyridazine-4-carboxylic acid

Molecular Formula: C6H6N2O3Molecular Weight: 154.123440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MHYFUPKDKSSFRZ-UHFFFAOYSA-N

• 1-Benzyl-4-iodo-1H-pyrazole
IUPAC Name: 4-iodo-1-(phenylmethyl)pyrazole | CAS Registry Number: 50877-42-4
Synonyms: 683574_ALDRICH, BM148, TL8003372

Molecular Formula: C10H9IN2Molecular Weight: 284.096330 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PVEYRBGIYMWFPB-UHFFFAOYSA-N

• 1,3-Dimethylpyrazole-5-carboxylic acid
IUPAC Name: 2,5-dimethylpyrazole-3-carboxylic acid | CAS Registry Number: 5744-56-9
Synonyms: ZERO/009877, CID587721, 1,3-Dimethyl-1H-pyrazole-5-carboxylic acid, Pyrazole-5-carboxylic acid, 1,3-dmethyl-, H09022, InChI=1/C6H8N2O2/c1-4-3-5(6(9)10)8(2)7-4/h3H,1-2H3,(H,9,10

Molecular Formula: C6H8N2O2Molecular Weight: 140.139920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QRWZFUBHOQWUGH-UHFFFAOYSA-N

• (S)-3-Chloro-1,2-propanediol
IUPAC Name: (2S)-3-chloropropane-1,2-diol | CAS Registry Number: 60827-45-4
Synonyms: alpha-Chlorohydrin, (S)-alpha-Chlorohydrin, sGPhMQDIK]UQX@, S-3-Chloro-1,2-propanediol, 3-Chloropropane-1,2-diol, CCRIS 7386, 1,2-Propanediol, 3-chloro-, 540064_ALDRICH, (S)-alpha-Glycerol chlorohydrin, 26077_FLUKA, 1,2-Propanediol, 3-chloro-, (S)-, ZINC02041174, (S)-()-3-Chloro-1,2-propanediol, (S)-(+)-3-Chloro-1,2-propanediol, LS-120253, TL8003855, InChI=1/C3H7ClO2/c4-1-3(6)2-5/h3,5-6H,1-2H, 96-24-2

Molecular Formula: C3H7ClO2Molecular Weight: 110.539480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SSZWWUDQMAHNAQ-GSVOUGTGSA-N

• 1-(4-Nitrophenyl)piperazine
IUPAC Name: 1-(4-nitrophenyl)piperazine | CAS Registry Number: 6269-89-2
Synonyms: Piperazine, 1-(4-nitrophenyl)-, Oprea1_305105, 1-(4-Nitrophenyl)-piperazine, 279773_ALDRICH, TOS-BB-0562, NSC33874, EINECS 228-443-7, SBB003475, ST5213758, TL8004239, InChI=1/C10H13N3O2/c14-13(15)10-3-1-9(2-4-10)12-7-5-11-6-8-12/h1-4,11H,5-8H

Molecular Formula: C10H13N3O2Molecular Weight: 207.229120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VWOJSRICSKDKAW-UHFFFAOYSA-N

• 4-Bromo-3-fluoroaniline
IUPAC Name: 4-bromo-3-fluoroaniline | CAS Registry Number: 656-65-5
Synonyms: 4-Bromo-3-fluorophenylamine, 518719_ALDRICH, ZINC00338968, CID821848, ST5408627, TL8004656, AA-516/30011027

Molecular Formula: C6H5BrFNMolecular Weight: 190.013003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YTMVYYAKOPIJCZ-UHFFFAOYSA-N

• 1-Piperidinecarboxylic acid, 3-cyano-,1,1-dimethylethyl ester
IUPAC Name: tert-butyl 3-cyanopiperidine-1-carboxylate | CAS Registry Number: 91419-53-3
Synonyms: 1-N-Boc-3-cyanopiperidine, n-boc-3-cyanopiperidine, 1-Boc-3-cyanopiperidine, tert-butyl 3-cyanopiperidine-1-carboxylate, N-Boc-3-cyano-piperidine, (+/-)-1-n-boc-3-cyano-piperidine, 1-n-boc-piperidine-3-carbonitrile, SBB066832, AG-H-75101, 3-cyano-piperidine-1-carboxylic acid tert-butyl ester, PubChem7634, AC1MBUD4, SureCN1970337, 1-n-boc-3-cyano-piperidine, KSC495C3N, AC1Q1N35, CTK3J5136, MolPort-000-151-677, BH572, ACT02053

Molecular Formula: C11H18N2O2Molecular Weight: 210.272820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UEFZTXGFHKPSFS-UHFFFAOYSA-N

• 1,2-dichloro-4,5-dinitro-benzene
IUPAC Name: 1,2-dichloro-4,5-dinitrobenzene | CAS Registry Number: 6306-39-4
Synonyms: Parazol, 1,2-Dichloro-4,5-dinitrobenzene, 1,2diCl4,5diNO2Ph, 4,5-Dichloro-1,2-dinitrobenzene, WLN: WNR CG DG FNW, Benzene, 1,2-dichloro-4,5-dinitro-, 300365_ALDRICH, NSC 22945, AIDS006011, AIDS-006011, CID80565, NSC22945, BRN 2460868, AI3-19504, LS-29796, 4-05-00-00747 (Beilstein Handbook Reference)

Molecular Formula: C6H2Cl2N2O4Molecular Weight: 236.997080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IGSAVPVCQHAPSM-UHFFFAOYSA-N

• 2-(4-methylpiperazino)benzylamine
IUPAC Name: [2-(4-methylpiperazin-1-yl)phenyl]methanamine | CAS Registry Number: 655256-68-1
Synonyms: 1-[2-(4-Methylpiperazin-1-yl)phenyl]methanamine, [2-(4-methylpiperazin-1-yl)phenyl]methanamine, ST065623, (2-(4-methylpiperazin-1-yl)phenyl)methanamine, 1-(2-(4-methylpiperazin-1-yl)phenyl)methanamine, PubChem9056, AC1MDTO7, SureCN110927, AC1Q3ZU0, CTK5C2836, MolPort-000-143-064, ACT08558, STK350937, AKOS000261381, 2-(4-Methylpiperazin-1-yl)benzylamine, AG-G-46723, MCULE-7661418792, QC-9097, RP26183, AK-23548

Molecular Formula: C12H19N3Molecular Weight: 205.299360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GRSJANZWLLXZFG-UHFFFAOYSA-N

• 1-methyl-4-nitro-1h-pyrrole-2-carboxylic Acid Ethyl Ester
IUPAC Name: ethyl 1-methyl-4-nitropyrrole-2-carboxylate | CAS Registry Number: 2853-29-4
Synonyms: ethyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate, 1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER, Ethyl 1-methyl-4-nitro-pyrrole-2-carboxylate, SureCN3477514, CTK4G1663, SBB067345, ZINC32917102, AKOS000265426, AB42943, AG-E-91724, AK-29086, KB-160066, FT-0646093, A819480, ETHYL 1-METHYL-4-NITROPYRROLE-2-CARBOXYLATE, I14-2989, 1-methyl-4-nitro-2-pyrrolecarboxylic acid ethyl ester, 1H-Pyrrole-2-carboxylicacid, 1-methyl-4-nitro-, ethyl ester, 1H-PYRROLE-2-CARBOXYLIC ACID, 1-METHYL-4-NITRO-, ETHYL ESTER, Pyrrole-2-carboxylicacid, 1-methyl-4-nitro-, ethyl ester (6CI,7CI);1-Methyl-4-nitropyrrole-2-carboxylicacid ethyl ester;Ethyl 1-methyl-4-nitropyrrole-2-carboxylate;

Molecular Formula: C8H10N2O4Molecular Weight: 198.176000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XOLGKCDCFJPOEY-UHFFFAOYSA-N

• 4,6-Dimethylpyrimidine-5-Carboxylic Acid
IUPAC Name: 4,6-dimethylpyrimidine-5-carboxylic acid | CAS Registry Number: 157335-93-8
Synonyms: 4,6-Dimethylpyrimidine-5-carboxylic acid, 5-Carboxy-4,6-dimethylpyrimidine, SBB053227, 5-Carboxy-4,6-dimethyl-1,3-diazine, AG-E-06330, 4,6-dimethylpyrimidine-5-carboxylicacid, 5-PYRIMIDINECARBOXYLIC ACID, 4,6-DIMETHYL-, PubChem17096, SureCN410293, ACMC-1C27Q, AGN-PC-0030HJ, Jsp003111, CTK0H4394, MolPort-000-003-527, AC-372, ANW-21692, AKOS012039530, AB42986, HP21291, QC-1745

Molecular Formula: C7H8N2O2Molecular Weight: 152.150620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: SBJRXHBKPCHGQY-UHFFFAOYSA-N

• 2-Iodoimidazole
IUPAC Name: 2-iodo-1H-imidazole | CAS Registry Number: 3034-62-6
Synonyms: sFtHEaVILiluH@, 641081_ALDRICH, ZINC02531019, TL8002340

Molecular Formula: C3H3IN2Molecular Weight: 193.973790 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MHHDMDLNVVCTAJ-UHFFFAOYSA-N

• 1-methyl-3-piperidinemethanol
IUPAC Name: (1-methylpiperidin-3-yl)methanol | CAS Registry Number: 7583-53-1
Synonyms: 1-Methyl-3-piperidinemethanol, 1-Methyl-3-hydroxymethylpiperidine, (1-Methyl-3-piperidyl)methanol, NSC66541, STOCK2S-16008, 3-Hydroxymethyl-1-methylpiperidine, CID97998, EINECS 231-488-5, TL8005184

Molecular Formula: C7H15NOMolecular Weight: 129.200100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UGXQXVDTGJCQHR-UHFFFAOYSA-N

• 1-methyl-5-nitro-1H-indole
IUPAC Name: 1-methyl-5-nitroindole | CAS Registry Number: 29906-67-0
Synonyms: 1-Methyl-5-nitro-1H-indole, 1H-Indole, 1-methyl-5-nitro-, ZINC04272216, SL-02719

Molecular Formula: C9H8N2O2Molecular Weight: 176.172020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PXBQSCHRKSBGKV-UHFFFAOYSA-N

• (3R,4S)-3-triethylsilanyloxy -4-phenyl-N-Boc-2-azetidinone
IUPAC Name: tert-butyl (3R,4S)-2-oxo-4-phenyl-3-triethylsilyloxyazetidine-1-carboxylate | CAS Registry Number: 149198-47-0
Synonyms: (3R,4S)-tert-Butyl 2-oxo-4-phenyl-3-(triethylsilyloxy)azetidine-1-carboxylate, (3R,4S)-tert-Butyl 2-oxo-4-phenyl-3-((triethylsilyl)oxy)azetidine-1-carboxylate, (3R,4S)-2-Oxo-4-phenyl-3-triethylsilanyloxy-azetidine-1-carboxylic acid tert-butyl ester, SureCN5887148, CTK4C6076, 1-Azetidinecarboxylicacid, 2-oxo-4-phenyl-3-[(triethylsilyl)oxy]-, 1,1-dimethylethyl ester, (3R,4S)-, ANW-65735, AKOS015909778, AC-4263, AG-D-95206, RL01891, AK-89088, H557, KB-207576, I14-3226, (3R,4S)-1-t-Boc-3-[(triethylsilyl)oxy]-4-phenyl-2-azatidinone, (3R,4S)-2-Oxo-4-phenyl-3-[(triethylsilyl)oxy]-1-azetidinecarboxylic Acid 1,1-Dimethylethyl Ester, (3R-cis)-2-Oxo-4-phenyl-3-[(triethylsilyl)oxy]-1-azetidinecarboxylic Acid 1,1-Dimethylethyl Ester, 1-Azetidinecarboxylicacid, 2-oxo-4-phenyl-3-[(triethylsilyl)oxy]-, 1,1-dimethylethyl ester,(3R-cis)-;(3R,4S)-2-Oxo-4-phenyl-3-[(triethylsilyl)oxy]-1-azetidinecarboxylicacid 1,1-dimethylethyl ester;

Molecular Formula: C20H31NO4SiMolecular Weight: 377.549940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: LHTDXUKSFSMGCA-DLBZAZTESA-N

• 1-Boc-3-methylaminopiperidine
IUPAC Name: tert-butyl 3-(methylamino)piperidine-1-carboxylate | CAS Registry Number: 392331-89-4
Synonyms: 1-Boc-3-methylaminopieridine, TL8002833, C-3123, 3-(Methylamino)piperidine-1-carboxylic acid tert-butyl ester

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

InChIKey: XRRRUOWSHGFPTI-UHFFFAOYSA-N

• (S)-(-)-1,2,3,4-Tetrahedro-naphthoic acid
IUPAC Name: (1S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid | CAS Registry Number: 85977-52-2
Synonyms: (S)-1,2,3,4-tetrahydro-1-naphthoic acid, (S)-1,2,3,4-tetrahydro-naphthoic acid, PubChem11869, SureCN2796237, CTK3E8704, MolPort-003-987-318, ANW-46646, OR4201, AKOS015833089, AC-6928, AG-H-46849, BD22877, AK-48549, KB-63344, TL8005600, FT-0642021, (1S)-1,2,3,4-Tetrahydro-1-naphthoic acid, (S)-(-)-1,2,3,4-Tetrahydro-naphthoic acid, (1S)-1-Carboxy-1,2,3,4-tetrahydronaphthalene, (1S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VDLWTJCSPSUGOA-JTQLQIEISA-N

• (1R,2R)-1-amino-2,3-dihydro-1H-inden-2-ol
IUPAC Name: (1R,2R)-1-amino-2,3-dihydro-1H-inden-2-ol | CAS Registry Number: 163061-73-2
Synonyms: (1R,2R)-(-)-trans-1-Amino-2-indanol, AG-G-94527, (1R,2R)-(-)-1-Amino-2-indanol, (1R,2R)-(-)-1-Amino-2-hydroxyindan, Trans-1-amino-2-indanol, SureCN192072, AC1OC2C6, 663336_ALDRICH, (1r,2r)-1-aminoindan-2-ol, CTK0H3979, ANW-22025, AKOS015854133, TRANS-1-AMINO-2-HYDROXYINDANE, AK-59915, AB1011445, KB-205287, (1R,2R)-1-azanyl-2,3-dihydro-1H-inden-2-ol, A810438, I14-38555, I14-38573

Molecular Formula: C9H11NOMolecular Weight: 149.189740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LOPKSXMQWBYUOI-RKDXNWHRSA-N

• 1-(4-bromobenzyl)-1-(4-methoxyphenyl)hydrazine
IUPAC Name: 1-[(4-bromophenyl)methyl]-1-(4-methoxyphenyl)hydrazine;hydrochloride | CAS Registry Number: 176045-80-0
Synonyms: SureCN1253767, 1-(4-BROMOBENZYL)-1-(4-METHOXYPHENYL)HYDRAZINE HYDROCHLORIDE

Molecular Formula: C14H16BrClN2OMolecular Weight: 343.646640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: POCICHKMHNYWIS-UHFFFAOYSA-N

• 1-N-Boc-2-isopropylpiperazine
IUPAC Name: tert-butyl 2-propan-2-ylpiperazine-1-carboxylate | CAS Registry Number: 886766-25-2
Synonyms: 1-Boc-2-Isopropylpiperazine, TERT-BUTYL 2-ISOPROPYLPIPERAZINE-1-CARBOXYLATE, 1-BOC-2-ISOPROPYL-PIPERAZINE, 1-Boc- 2-isopropyl-piperazine, AG-H-58572, tert-butyl2-isopropylpiperazine-1-carboxylate, 2-ISOPROPYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, SureCN873224, AGN-PC-01LR6J, CTK5G1188, MolPort-003-985-763, (S)-N1-Boc-2-isopropylpiperazine, ANW-44808, AKOS005259402, AB44483, OR15647, RP00221, AK-30400, KB-60920, AB1005780

Molecular Formula: C12H24N2O2Molecular Weight: 228.331160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NZTWGWFHWJARJX-UHFFFAOYSA-N

• (S)-1-Boc-3-benzyl-piperazine
IUPAC Name: tert-butyl (3S)-3-benzylpiperazine-1-carboxylate | CAS Registry Number: 475272-55-0
Synonyms: (S)-1-Boc-3-benzylpiperazine, (S)-tert-butyl 3-benzylpiperazine-1-carboxylate, AG-F-61772, (S)-3-BENZYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, SureCN17058, CTK4J0076, MolPort-000-140-597, BH128, ANW-44813, FC0173, ZINC15022056, AKOS005258659, AKOS015911334, AB42214, AC-2221, RP06574, (S)-4-BOC-2-BENZYL-PIPERAZINE, AK-29277, KB-63432, AB1006411

Molecular Formula: C16H24N2O2Molecular Weight: 276.373960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YFIAVMMGSRDLLG-AWEZNQCLSA-N

• (+)-Pinanediol
IUPAC Name: (1S,3R,4S,5S)-4,6,6-trimethylbicyclo[3.1.1]heptane-3,4-diol | CAS Registry Number: 18680-27-8
Synonyms: (1S,2S,3R,5S)-(+)-2,3-pinanediol, (1S,2S,3R,5S)-(+)-Pinanediol, (+)-2-Hydroxyisopinocampheol, (1S,2S,3R,5S)-2,6,6-Trimethylbicyclo[3.1.1]heptane-2,3-diol, (1S,2S,3R,5S)-2,3-Pinanediol, Pinanediol, (+)-, PubChem17357, UNII-Y6ZCV4AVRA, 2alpha,3alpha-Pinanediol, SureCN621468, KSC174G4P, Jsp003826, CTK0H4347, MolPort-002-904-005, ACN-S003508, ACT02840, ANW-23308, CX1160, ZINC02539352, AKOS005256255

Molecular Formula: C10H18O2Molecular Weight: 170.248720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MOILFCKRQFQVFS-OORONAJNSA-N

• 1-iodo-3,4-methylenedioxybenzene
IUPAC Name: 5-iodo-1,3-benzodioxole | CAS Registry Number: 5876-51-7
Synonyms: 5-Iodo-1,3-benzodioxole, nchembio.87-comp35, 1-Iodo-3,4-methylenedioxybenzene, 5-Iodo-benzo[1,3]dioxole, ZINC02571866

Molecular Formula: C7H5IO2Molecular Weight: 248.017870 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NMMCBIXYIYQHCP-UHFFFAOYSA-N

• 1-Acetyladamantane
IUPAC Name: 1-(1-adamantyl)ethanone | CAS Registry Number: 1660-04-4
Synonyms: 1-Adamantyl methyl ketone, Ambap2137, 148237_ALDRICH, EINECS 216-761-9, SBB008487, ZINC03861155, FR-2164, Ethanone, 1-tricyclo[3.3.1.1(3,7)-]dec-1-yl-, Ethanone, 1-tricyclo(3.3.1.13,7)dec-1-yl-, Methyl tricyclo(3.3.1.13,7)dec-1-yl ketone

Molecular Formula: C12H18OMolecular Weight: 178.270720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DACIGVIOAFXPHW-UHFFFAOYSA-N

• 1-Bromo-2-Fluoroethane
IUPAC Name: 1-bromo-2-fluoroethane | CAS Registry Number: 762-49-2
Synonyms: 2-Bromofluoroethane, 2-Fluoroethyl bromide, Ethane, 1-bromo-2-fluoro-, 1-BROMO-2-FLUOROETHANE, 1-Fluoro-2-bromoethane, HSDB 6788, EINECS 212-100-3, NSC172603, LS-65227

Molecular Formula: C2H4BrFMolecular Weight: 126.955563 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JTLAIKFGRHDNQM-UHFFFAOYSA-N

• 4-Amino-3,5-Dichloroacetophenone
IUPAC Name: 1-(4-amino-3,5-dichlorophenyl)ethanone | CAS Registry Number: 37148-48-4
Synonyms: 4-Amino-3,5-dichloroacetophenone, 536148_ALDRICH, 3,5-Dichloro-4-aminoacetophenone, EINECS 253-368-1, SBB003511, ZINC02561206, 4'-Amino-3',5'-dichloroacetophenone, 1-(4-Amino-3,5-dichlorophenyl)-ethanone, TL8002736, 1-(4-Amino-3,5-dichlorophenyl)ethan-1-one, Ethanone, 1-(4-amino-3,5-dichlorophenyl)-

Molecular Formula: C8H7Cl2NOMolecular Weight: 204.053280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JLPKZJDZXIKSCP-UHFFFAOYSA-N

• 2-Fluoro-5-bromo-3-pyridineboronic Acid
IUPAC Name: (5-bromo-2-fluoropyridin-3-yl)boronic acid | CAS Registry Number: 501435-91-2
Synonyms: TE6157, 5-Bromo-2-fluoropyridine-3-boronic acid, 5-bromo-2-fluoro-3-pyridinylboronic acid, ST5408849

Molecular Formula: C5H4BBrFNO2Molecular Weight: 219.804163 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YAXKWQSQZIVTFC-UHFFFAOYSA-N

• 2-Fluoro-5-formylphenylboronic Acid
IUPAC Name: (2-fluoro-5-formylphenyl)boronic acid | CAS Registry Number: 352534-79-3
Synonyms: 2-Fluoro-5-formylphenylboronic acid, F2227G1, TL8002622

Molecular Formula: C7H6BFO3Molecular Weight: 167.930143 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SQSWYWCEKCVQEA-UHFFFAOYSA-N

• (D)-(+)-Methylalpha-(2-Thienylethamino)(2-Chlorophenyl)acetate.HCl
IUPAC Name: [2-(4-methyl-2-phenylpiperazin-1-yl)pyridin-3-yl]methanol | CAS Registry Number: 61337-89-1
Synonyms: 1-(3-hydroxymethylpyridin-2-yl)-4-methyl-2-phenylpiperazine, 337376-18-8, 2-(4-Methyl-2-phenyl-1-piperazinyl)-3-pyridinemethanol, 1-(3-hydroxidmethylpyridine)-2-phenyl-4-methyl-piperazine, Mirtazapine Impurity B, PubChem20817, SureCN1325599, AGN-PC-00C01S, CTK4H1148, MolPort-005-935-437, SBB063505, AKOS010505275, AG-F-14040, AG-L-63314, AC-15710, AK-26183, AK113415, I132, KB-147024, KB-163064

Molecular Formula: C17H21N3OMolecular Weight: 283.368140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: PYZPABZGIRHQTA-UHFFFAOYSA-N

• 4-Acetamido-3-bromoacetophenone
IUPAC Name: N-(4-acetyl-2-bromophenyl)acetamide | CAS Registry Number: 101209-08-9
Synonyms: 4'-Acetamido-3'-bromoacetophenone, N-(4-acetyl-2-bromophenyl)acetamide, SBB058022, ZINC00156624, AC1MVFK6, AC1Q1KHA, SureCN842209, 680346_ALDRICH, CTK8E4725, 4'-Acetamido-3-Bromoacetophenone, MolPort-000-150-260, 3'-Bromo-4'-acetaminoacetophenone, ACT08037, AKOS005206869, MCULE-8641336741, FS000804, KB-30191, KB-36107, N-(2-bromanyl-4-ethanoyl-phenyl)ethanamide, FT-0617370

Molecular Formula: C10H10BrNO2Molecular Weight: 256.095900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PMYJAVHDFDKJBS-UHFFFAOYSA-N

• 4-Acetylaminophenylboronic acid
IUPAC Name: (4-acetamidophenyl)boronic acid | CAS Registry Number: 101251-09-6
Synonyms: 4-Acetamidophenylboronic acid, 565806_ALDRICH, BM060, SBB000202, TL8007159

Molecular Formula: C8H10BNO3Molecular Weight: 178.980900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: VYEWTHXZHHATTA-UHFFFAOYSA-N

• 4-Butoxymethylboronic acid
IUPAC Name: (4-butoxyphenyl)boronic acid | CAS Registry Number: 105365-51-3
Synonyms: 4-Butoxyphenylboronic acid, 4-n-Butoxyphenylboronic acid, 542504_ALDRICH, B2027G1, TL8000203

Molecular Formula: C10H15BO3Molecular Weight: 194.035300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QUPFQMXWFNJUNJ-UHFFFAOYSA-N

• 1,4-cyclohexane dicarboxylic acid
IUPAC Name: cyclohexane-1,4-dicarboxylic acid | CAS Registry Number: 1076-97-7
Synonyms: cis-Hexahydroterephthalic acid, Hexahydroterephthalic acid, 1,4-Dicarboxycyclohexane, trans-Hexahydroterephthalic acid, 1,4-CYCLOHEXANEDICARBOXYLIC ACID, Maybridge1_003835, Terephthalic acid, hexahydro-, cis-1,4-Cyclohexanedicarboxylic acid, 1,4-CHDA-HP, C100757_ALDRICH, trans-1,4-Cyclohexanedicarboxylic acid, 538035_ALDRICH, NSC621, EINECS 214-068-6, 1,4-Cyclohexanedicarboxylic acid,c&t, cyclohexane-1,4-dicarboxylic acid, 1,4-Cyclohexanedicarboxylic acid, trans-, NSC61121, EINECS 210-614-2, SBB008430

Molecular Formula: C8H12O4Molecular Weight: 172.178480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PXGZQGDTEZPERC-UHFFFAOYSA-N

• 1-Iodo-4-(trans-4-n-propylcyclohexyl)benzene
IUPAC Name: 1-iodo-4-(4-propylcyclohexyl)benzene | CAS Registry Number: 111158-11-3
Synonyms: SureCN712306, SureCN712307, AGN-PC-000TZK, SureCN13235212, ZINC49588466, 1-iodo-4-(4-propylcyclohexyl)benzene, AKOS015914906, KB-64101, 4-(trans-4'-n-propylcyclohexyl)iodobenzene, 1-(Trans-4-propylcyclohexyl)-4-iodobenzene, FT-0642720, ST51055531, 1-IODO-4-(4-PROPYL-CYCLOHEXYL)-BENZENE, I14-6933, I14-9007

Molecular Formula: C15H21IMolecular Weight: 328.231710 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QBYHVVBZXPJPKK-UHFFFAOYSA-N

• 4-N-Boc-2-methylpiperazine
IUPAC Name: tert-butyl 3-methylpiperazine-1-carboxylate | CAS Registry Number: 120737-59-9
Synonyms: 4-n-boc-2-methyl-piperazine, Tert-butyl 3-methylpiperazine-1-carboxylate, 4-boc-2-methyl-piperazine, 1-boc-3-methylpiperazine, 2-methylpiperazine, n4-boc protected, 1-boc-3-methyl-piperazine, 2-methyl-4-boc-piperazine, 4-boc-2-methyl piperazine, n-1-boc-3-methylpiperazine, N-1-Boc-3-methyl piperizine, tert-Butyl 3-methyl-1-piperazinecarboxylate, (+/-)-n4-boc-2-methylpiperazine, SBB056121, 3-methyl-piperazine-1-carboxylic acid tert-butyl ester, 3-methylpiperazine-1-carboxylic acid tert-butyl ester, (S)-2-Methyl-1-Boc-piperazine, PubChem9403, AC1MBUF7, 4-boc-2-methylpiperazine, SureCN16018

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FMLPQHJYUZTHQS-UHFFFAOYSA-N

• 1,3,-Dichloro-4,6-dinitrobenzene
IUPAC Name: 1,5-dichloro-2,4-dinitrobenzene | CAS Registry Number: 3698-83-7
Synonyms: 1,3-Dichloro-4,6-dinitrobenzene, 1,5-Dichloro-2,4-dinitrobenzene, 2,4-Dichloro-1,5-dinitrobenzene, 4,6-Dichloro-1,3-dinitrobenzene, 513237_ALDRICH, Benzene, 1,5-dichloro-2,4-dinitro-, EINECS 223-027-1, NSC 28971, NSC28971, ZINC01651867, AI3-28912, LS-184937, ST5410230, TL8002729

Molecular Formula: C6H2Cl2N2O4Molecular Weight: 236.997080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ZPXDNSYFDIHPOJ-UHFFFAOYSA-N

• 1-Propanone, 1-(4-chlorophenyl)-2-cyclopropyl-
IUPAC Name: 1-(4-chlorophenyl)-2-cyclopropylpropan-1-one | CAS Registry Number: 123989-29-7
Synonyms: 1-(4-CHLOROPHENYL)-2-CYCLOPROPYLPROPAN-1-ONE, AGN-PC-00MRPD, SureCN868012, AKOS015911006, AK135548, KB-147242, I14-38515

Molecular Formula: C12H13ClOMolecular Weight: 208.684020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LRWCURGZPQWMRG-UHFFFAOYSA-N

• 1-Butyl-3-methylimidazolium tetrafluoroborate
IUPAC Name: 1-butyl-3-methylimidazol-3-ium;tetrafluoroborate | CAS Registry Number: 174501-65-6
Synonyms: BMIMBF4, 1-n-Butyl-3-Methylimidazolium Tetrafluoroborate, AG-E-24087, Bmim tetrafluoroborate, Basionics® EE 04, ACMC-209e8d, AC1MC0J5, AGN-PC-008UBP, DSSTox_CID_29087, DSSTox_RID_83306, UNII-T2TVZ2306T, DSSTox_GSID_49231, KSC174I1T, 91508_ALDRICH, Jsp003572, BMIMBF4; Basionics? EE 04, 39931_FLUKA, 91508_FLUKA, CTK0H4419, MolPort-003-931-804

Molecular Formula: C8H15BF4N2Molecular Weight: 226.022713 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: LSBXQLQATZTAPE-UHFFFAOYSA-N

• (R)-3-amino-2,3,4,5-tetrahydro-1H-benzazepin-2-one
IUPAC Name: (3R)-3-amino-1,3,4,5-tetrahydro-1-benzazepin-2-one | CAS Registry Number: 137036-55-6
Synonyms: (R)-3-Amino-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one, (R)-3-amino-4,5-dihydro-1H-benzo[b]azepin-2(3H)-one, (R)-3-amino-2-Oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepine, PubChem16168, SureCN1269652, 2H-1-Benzazepin-2-one,3-amino-1,3,4,5-tetrahydro-, (3R)-, CTK4C0607, WTI-10259, AKOS005257342, AKOS006271746, AG-D-75416, RP23795, KB-03161, A807174, I14-32575, (3R)-3-amino-1,3,4,5-tetrahydro-1-benzazepin-2-one, (3R)-3-azanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one, 2H-1-Benzazepin-2-one,3-amino-1,3,4,5-tetrahydro-, (R)-; (+)-a-Aminotetrahydro-2-benzazepinone; (R)-3-Amino-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one

Molecular Formula: C10H12N2OMolecular Weight: 176.215080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: AUAKXRGQXZRTQC-MRVPVSSYSA-N

• (S)-1-Methyl-3-pyrrolidinol
IUPAC Name: (3S)-1-methylpyrrolidin-3-ol | CAS Registry Number: 104641-59-0
Synonyms: (S)-(+)-1-Methyl-3-pyrrolidinol, (3S)-1-methylpyrrolidin-3-ol, (S)-(+)-1-Methyl-3-hydroxypyrrolidine, (S)-3-Hydroxy-1-methylpyrrolidine, AG-D-17108, (S)-(+)-3-Hydroxy-N-methylpyrrolidine, (S)-3-HYDROXY-1-METHYL-PYRROLIDINE, 3-Pyrrolidinol, 1-methyl-, AC1LD7DM, SureCN134941, 573337_ALDRICH, Jsp000456, (3S)-1-methyl-3-pyrrolidinol, CTK3J6025, MolPort-001-768-441, ACT05086, ANW-15090, OR4625, AKOS015850701, AC-7092

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FLVFPAIGVBQGET-YFKPBYRVSA-N

• (r)-(+)-3,5-Xylyl-Binap
IUPAC Name: [1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane | CAS Registry Number: 137219-86-4
Synonyms: (S)-DM-BINAP, DM-BINAP, 3,5-Xylyl-BINAP, (R)-DM-BINAP, (S)-3,5-Xylyl-BINAP, 135139-00-3, (S)-(-)-2,2'-Bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl, RAC-XYLYL-BINAP, (R)-XYLYL-BINAP, (S)-XYLYL-BINAP, AC1N55SJ, (R)-(+)-XYLBINAP, (S)-(-)-XYLBINAP, RAC-3,5-XYLYL-BINAP, (R)-3,5-XYLYL-BINAP, CTK8E7376, (R)-(+)-3,5-XYLBINAP, (S)-(-)-3,5-XYLBINAP, AKOS015842419, SC11258

Molecular Formula: C52H48P2Molecular Weight: 734.885044 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MXGXXBYVDMVJAO-UHFFFAOYSA-N

• 4-Bromo Ethyl Benzene
IUPAC Name: 1-bromo-4-ethylbenzene | CAS Registry Number: 1585-07-5
Synonyms: p-Bromoethylbenzene, p-Ethylbromobenzene, 4-Ethylbromobenzene, Benzene, 1-bromo-4-ethyl-, 1-BROMO-4-ETHYLBENZENE, 111414_ALDRICH, NSC60144, CID15313, EINECS 216-439-8, NSC 60144, ST5406251, InChI=1/C8H9Br/c1-2-7-3-5-8(9)6-4-7/h3-6H,2H2,1H

Molecular Formula: C8H9BrMolecular Weight: 185.061060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: URFPRAHGGBYNPW-UHFFFAOYSA-N

• 1,3,5-Cycloheptariene
IUPAC Name: cyclohepta-1,3,5-triene | CAS Registry Number: 544-25-2
Synonyms: Tropilidene, Cycloheptatriene, Tropilidine, Tropiliden, Cycloheptatrien, Zykloheptatrien, Tropyliden, 1,3,5-CYCLOHEPTATRIENE, 1H-[7]annulene, Cyclohepta-1,3,5-triene, C99205_ALDRICH, CHEBI:37519, EINECS 208-866-3, UN2603, CID11000, LS-56137, Cycloheptatriene [UN2603] [Flammable liquid], Cycloheptatriene [UN2603] [Flammable liquid], InChI=1/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H

Molecular Formula: C7H8Molecular Weight: 92.138420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CHVJITGCYZJHLR-UHFFFAOYSA-N

• 1-(3-Pyridyl)ethan-1-One Oxime
IUPAC Name: (NE)-N-(1-pyridin-3-ylethylidene)hydroxylamine | CAS Registry Number: 5973-83-1
Synonyms: 3-Acetylpyridine oxime, WLN: T6NJ CY1&UNQ, 1-Pyridin-3-yl-ethanone oxime, Ethanone, 1-(3-pyridinyl)-, oxime, KETONE, METHYL 3-PYRIDYL, OXIME, STOCK1S-64936, NSC 72375, NSC72375, BRN 0114168, ZINC12356952, CID5708334, LS-87320, Ethanone, 1-(3-pyridinyl)-, oxime (9CI), P67448, 5-21-07-00395 (Beilstein Handbook Reference)

Molecular Formula: C7H8N2OMolecular Weight: 136.151220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MSRXORUOQNNOKN-RMKNXTFCSA-N

• 4h-Carbazol-4-One, 3-[(dimethylamino)methyl]-1,2,3,9-Tetrahydro-9-Methyl-, Monohydrochloride
IUPAC Name: 3-[(dimethylamino)methyl]-9-methyl-2,3-dihydro-1H-carbazol-4-one;hydrochloride | CAS Registry Number: 119812-29-2
Synonyms: 3-((Dimethylamino)methyl)-9-methyl-2,3-dihydro-1H-carbazol-4(9H)-one hydrochloride, 3-[(Dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazole-4-one HCl, SureCN5202651, CTK6I0373, MolPort-003-987-508, SBB068558, AKOS015912143, AG-A-53745, AK114281, K788, KB-29144, AB1006853, KB-232344, TL8006073, M-1309, A804362, I14-7384, I14-35770, 3-(dimethylamino)methyl-1.2.3.9-tetrhydro-9-methyl-4H-carbazol-4-one hydrochloride, 3-[(dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-one HCL

Molecular Formula: C16H21ClN2OMolecular Weight: 292.803740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GFQLILQFQHMEPF-UHFFFAOYSA-N


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