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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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• (R)-1-N-Boc-piperazine-3-carboxylic acid methyl ester
IUPAC Name: 1-O-tert-butyl 3-O-methyl (3R)-piperazine-1,3-dicarboxylate | CAS Registry Number: 438631-77-7
Synonyms: Methyl (R)-1-N-Boc-piperazine-3-carboxylate, (r)-1-n-boc-piperazine-3-carboxylic acid methyl ester, (R)-4-N-Boc-piperazine-2-carboxylic acid methyl ester, AG-F-54775, 1-tert-butyl 3-methyl (3r)-piperazine-1,3-dicarboxylate, 1,3-Piperazinedicarboxylic acid, 1-(1,1-dimethylethyl) 3-methyl ester, (3R)-, (r)-1-tert-butyl 3-methyl piperazine-1,3-dicarboxylate, (r)-piperazine-1,3-dicarboxylic acid 1-tert-butyl ester 3-methyl ester, PubChem19764, (R)-4-N-Boc-piperazine-2-carboxylicacidmethylester, SureCN881661, AC1O6ND6, CTK4I7838, MolPort-000-006-037, ANW-49866, ZINC21297736, [(4-n-boc)piperazine(2r) cooh]-ome, AKOS005258553, AC-2202, PB10296

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

InChIKey: QUKAHFCVKNRRBU-MRVPVSSYSA-N

• (S)-1-Boc-2-propyl-piperazine
IUPAC Name: tert-butyl (2S)-2-propylpiperazine-1-carboxylate | CAS Registry Number: 888972-67-6
Synonyms: (S)-1-Boc-2-propylpiperazine, (S)-1-Boc -2-propyl-piperazine, AG-H-59918, SureCN4309075, (S)-2-PROPYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, CTK5G1986, AKOS005258577, AKOS015910489, AC-2207, AK-30166, KB-03652, AB1005777, FT-0083960, FT-0601740, ST51055055, B-1396, I14-3983, 1-Piperazinecarboxylicacid, 2-propyl-, 1,1-dimethylethyl ester, (2S)-, (S)-1-Boc-2-propylpiperazine; (2S)-1-N-BOC-2-propylpiperazine; (R)-tert-butyl 3-propylpiperazine-1-carboxylate, 1-N-boc-2-n-propylpiperazine;(S)-1-Boc -2-propyl-piperazine;(S)-1-Boc-2-propyl-piperazine;(R)-1-Boc-2-propyl-piperazine;

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

InChIKey: PYTGOQORCFQPSZ-JTQLQIEISA-N

• 1-Boc-3-isopropyl-piperazine
IUPAC Name: tert-butyl 3-propan-2-ylpiperazine-1-carboxylate | CAS Registry Number: 502649-32-3
Synonyms: 1-Boc-3-isopropylpiperazine, AG-F-68775, tert-butyl 3-isopropylpiperazine-1-carboxylate, ACMC-1AXM1, SureCN1467860, CTK4J2332, MolPort-003-985-765, ANW-72717, 1-N-BOC-3-ISOPROPYLPIPERAZINE, AKOS005258422, AB44486, AC-2212, AK-29314, KB-11434, AB1005785, FT-0083904, FT-0601748, A26022, B-1404, I14-3876

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

InChIKey: UHLAQCKNCBYTIF-UHFFFAOYSA-N

• (S)-1-Boc-3-hydroxymethyl-piperazine
IUPAC Name: tert-butyl (3S)-3-(hydroxymethyl)piperazine-1-carboxylate | CAS Registry Number: 314741-40-7
Synonyms: (S)-1-Boc-3-hydroxymethylpiperazine, (S)-4-N-Boc-2-Hydroxymethyl-piperazine, (S)-4-Boc-2-(Hydroxymethyl)piperazine, (S)-3-Hydroxymethyl-piperazine-1-carboxylic acid tert-butyl ester, (s)-tert-butyl 3-(hydroxymethyl)piperazine-1-carboxylate, (s)-4-n-boc-2-(hydroxymethyl)piperazine, (s)-1-boc-3-(hydroxymethyl)piperazine, (s)-1-n-boc-3-hydroxymethyl-piperazine, tert-butyl (3S)-3-(hydroxymethyl)piperazine-1-carboxylate, (s)-3-hydroxymethylpiperazine-1-carboxylic acid tert-butyl ester, PubChem23944, SureCN1462710, KSC222C7F, Jsp005871, CTK1C2172, MolPort-000-004-177, PS-J-054, ANW-52345, RW3042, ZINC54959965

Molecular Formula: C10H20N2O3Molecular Weight: 216.277400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NSILYQWHARROMG-QMMMGPOBSA-N

• (2S,4S)-4-Fluoropyrrolidine-2-carboxylic acid
IUPAC Name: (2S,4S)-4-fluoropyrrolidine-2-carboxylic acid | CAS Registry Number: 6745-32-0
Synonyms: (2S,4S)-4-fluoropyrrolidine-2-carboxylic acid, cis-4-Fluoroproline, cis-4-Fluoro-L-proline, 2438-57-5, AG-G-55024, (2S,4S)-4-fluoro-2-pyrrolidinecarboxylic acid, (2S,4S)-4-fluoranylpyrrolidine-2-carboxylic acid, 4-Fluoro-pyrrolidine-2-carboxylic acid, PubChem18395, SureCN661917, AC1Q71AC, S-4-FLUORO-L-PROLINE, H-CIS-PRO(4-F)-OH, L-Proline, 4-fluoro-, cis-, CIS-4-FLUORO-L-PRO-OH, H-CIS-4-FLUORO-PRO-OH, CTK5C6182, (4S)-4-FLUOR-L-PROLIN, MolPort-000-140-559, (2S,4S)-4-FLUOROPROLINE

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

InChIKey: ZIWHMENIDGOELV-IMJSIDKUSA-N

• 4-Chloro-5-iodopyrimidine
IUPAC Name: 4-chloro-5-iodopyrimidine | CAS Registry Number: 63558-65-6
Synonyms: 4-Chloro-5-iodo-pyrimidine, AG-G-36125, PubChem7344, AGN-PC-004UPJ, 4-Chloro-5-iodopyrimidine;, KSC493O7D, Pyrimidine, 4-chloro-5-iodo-, CTK3J3771, MolPort-003-984-452, ACT01367, ANW-51162, ZINC21299825, AKOS012298915, PB23589, RP07160, AK-24022, BR-24022, EN001240, HC210326, KB-37988

Molecular Formula: C4H2ClIN2Molecular Weight: 240.429550 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BIWOQXBVRYUITN-UHFFFAOYSA-N

• 2,4-Dichloropyrimidine-5-carbonyl chloride
IUPAC Name: 2,4-dichloropyrimidine-5-carbonyl chloride | CAS Registry Number: 2972-52-3
Synonyms: 2,4-Dichloro-5-pyrimidinecarbonyl chloride, 2,4-dichloropyrimidine-5-carbonyl chloride, 2,4-Dichloro-5-pyrimidinecarbonylchloride, 5-(Chlorocarbonyl)-2,4-dichloropyrimidine, 5-PYRIMIDINECARBONYL CHLORIDE, 2,4-DICHLORO-, PubChem20115, ACMC-20a0te, AC1Q3G6W, AGN-PC-00NYY6, CTK1A1777, MolPort-000-003-500, ANW-51984, SBB067931, ZINC11804390, AKOS000149268, AB51120, AG-E-96950, QC-9254, RP04790, AK-23568

Molecular Formula: C5HCl3N2OMolecular Weight: 211.433240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DZTIFMWYYHCREC-UHFFFAOYSA-N

• (R)-1-(4-Fluorophenyl)ethanol
IUPAC Name: (1R)-1-(4-fluorophenyl)ethanol | CAS Registry Number: 101219-68-5
Synonyms: (1R)-1-(4-fluorophenyl)ethanol, SBB064275, AC1LGWGR, PubChem14245, SureCN1962791, CTK3J9612, MolPort-001-771-481, ANW-63567, SC1239, ZINC00388214, AKOS010397616, (1R)-1-(4-fluorophenyl)ethan-1-ol, AG-D-07663, AK-79218, KB-02663, Benzenemethanol,4-fluoro-a-methyl-, (aR)-, FT-0605115, A825062, 3S210904, I01-4527

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

InChIKey: PSDSORRYQPTKSV-ZCFIWIBFSA-N

• (R)-1-(4-chlorophenyl)ethanol
IUPAC Name: (1R)-1-(4-chlorophenyl)ethanol | CAS Registry Number: 75968-40-0
Synonyms: (R)-1-(4-Chlorophenyl)ethanol, (1R)-1-(4-chlorophenyl)ethanol, Benzenemethanol, 4-chloro-alpha-methyl-, PubChem14249, AC1LD6Z2, SureCN1253041, CTK8B9917, MolPort-011-138-775, ANW-63568, SC1272, ZINC00388285, AKOS012670049, (R)-4-Chloro-|A-methylbenzyl alcohol, AG-H-02955, AK-79217, KB-63102, A9640, FT-0688889, A821996, I01-4547

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

InChIKey: MVOSNPUNXINWAD-ZCFIWIBFSA-N

• (R)-(+)-1-(4-Bromophenyl)ethylamine
IUPAC Name: 1-(4-bromophenyl)ethanamine | CAS Registry Number: 45791-36-4
Synonyms: p-Bromo-alpha-methylbenzylamine, 154067_ALDRICH, 4-Bromo-alpha-methylbenzylamine, (+)-p-Bromo-.alpha.-phenethylamine, (-)-1-(4-Bromophenyl)ethylamine, EINECS 246-200-3, EINECS 256-245-0, (R)-4-Bromo-alpha-methylbenzylamine, SBB006746, Benzenemethanamine, 4-bromo-.alpha.-methyl-, (R)-, InChI=1/C8H10BrN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H, 24358-62-1, 27298-97-1

Molecular Formula: C8H10BrNMolecular Weight: 200.075700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SOZMSEPDYJGBEK-UHFFFAOYSA-N

• (S)-3-Amino-3-(4-chloro-phenyl)-propionic acid
IUPAC Name: (3S)-3-amino-3-(4-chlorophenyl)propanoic acid | CAS Registry Number: 131690-60-3
Synonyms: (s)-3-amino-3-(4-chlorophenyl)propionic acid, (S)-beta-(p-Chlorophenyl)alanine, (3S)-3-amino-3-(4-chlorophenyl)propanoic acid, (s)-3-(p-chlorophenyl)-beta-alanine, AG-D-64335, (s)-3-amino-3-(4-chlorophenyl)propanoic acid, (s)-3-amino-3-(4-chloro-phenyl)-propanoic acid, (S)- pound inverted question mark-(p-chlorophenyl)alanine, PubChem17328, h-beta-phe(4-cl)-oh, AC1LED0J, SureCN390335, h-d-phg(4-cl)-(c*ch2)oh, (s)-beta-4-chlorophenylalanine, (s)-4-chloro-beta-phenylalanine, CTK3J6940, MolPort-002-499-650, (s)-b-(p-chlorophenyl)-b-alanine, ACT09114, ANW-52349

Molecular Formula: C9H10ClNO2Molecular Weight: 199.634200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BXGDBHAMTMMNTO-QMMMGPOBSA-N

• 1,2,3,4-tetrahydroisoquinoline-3-carboxamide hydrochloride
IUPAC Name: 1,2,3,4-tetrahydroisoquinoline-3-carboxamide | CAS Registry Number: 112794-29-3
Synonyms: BB_SC-3415, ALBB-005451, BAS 14747243, CID4962026, 1,2,3,4-tetrahydroisoquinoline-3-carboxamide, 1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acid amide

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

InChIKey: JFMNKDRNEZZRBW-UHFFFAOYSA-N

• 1-Bromo-2,6-difluorobenzene
IUPAC Name: 2-bromo-1,3-difluorobenzene | CAS Registry Number: 64248-56-2
Synonyms: Benzene, 2-bromo-1,3-difluoro-, 2-Bromo-1,3-difluorobenzene, 263451_ALDRICH, EINECS 264-750-2, CID123557, ST5405158, InChI=1/C6H3BrF2/c7-6-4(8)2-1-3-5(6)9/h1-3

Molecular Formula: C6H3BrF2Molecular Weight: 192.988826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HRZTZLCMURHWFY-UHFFFAOYSA-N

• (S)-Methyl glycidyl ether
IUPAC Name: (2S)-2-(methoxymethyl)oxirane | CAS Registry Number: 64491-68-5
Synonyms: 454699_ALDRICH, (S)-()-Glycidyl methyl ether, (S)-()-Methyl glycidyl ether, 50025_FLUKA, (S)-()-2-(Methoxymethyl)oxirane, ZINC01556604

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

InChIKey: LKMJVFRMDSNFRT-SCSAIBSYSA-N

• (s)-Glycidyl butyrate
IUPAC Name: [(2S)-oxiran-2-yl]methyl butanoate | CAS Registry Number: 65031-96-1
Synonyms: (S)-(+)-Glycidyl butyrate, (S)-Oxiran-2-ylmethyl butyrate, (s)-Glycidyl Butyrate, S-Glycidyl butanoate, PubChem5837, AC1OE5OX, 460508_ALDRICH, CTK2F2826, Butyric Acid (S)-Glycidyl Ester, MolPort-001-766-726, ACT02373, ANW-34977, ZINC02036146, [(2S)-oxiran-2-yl]methyl butanoate, AKOS005259912, AKOS015892752, OR28822, RP17336, AK-44051, BR-44051

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

InChIKey: YLNSNVGRSIOCEU-LURJTMIESA-N

• (S)-(+)-2,2-Dimethyl-1,3-dioxolane-4-methanol
IUPAC Name: (2,2-dimethyl-1,3-dioxolan-4-yl)methanol | CAS Registry Number: 22323-82-6
Synonyms: Solketal, Glycerolacetone, Dioxolan, Acetone glycerol, Glycerol dimethylketal, Isopropylidene glycerol, Glycerol acetonide, DIOXOLANE, D-Acetone glycerol, Acetone monoglycerol ketal, Ambap651, Glycerinisopropylidene ether, 1,2-Isopropylideneglycerin, 1,2-Isopropylideneglycerol, 2,3-Isopropylideneglycerol, Glycerol acetonide (VAN), 1,2-O-Isopropylideneglycerol, 1,2-O,O-Isopropylideneglycerin, Glycerol, 1,2-O-isopropylidene, 2,3-(Isopropylidenedioxy)propanol

Molecular Formula: C6H12O3Molecular Weight: 132.157680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RNVYQYLELCKWAN-UHFFFAOYSA-N

• 1-Bromo-4-fluoronaphthalene
IUPAC Name: 1-bromo-4-fluoronaphthalene | CAS Registry Number: 341-41-3
Synonyms: 537195_ALDRICH, EINECS 206-434-9, CID67647, ST5408583

Molecular Formula: C10H6BrFMolecular Weight: 225.057043 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VAUJZKBFENPOCH-UHFFFAOYSA-N

• (1R,2R)-1,2-Diphenyl-1,2-ethanediamine
IUPAC Name: [(1R,2R)-2-azaniumyl-1,2-di(phenyl)ethyl]azanium | CAS Registry Number: 35132-20-8
Synonyms: ZINC00155131

Molecular Formula: C14H18N2+2Molecular Weight: 214.306120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: PONXTPCRRASWKW-ZIAGYGMSSA-P

• 1-Benzhydryl-3-azetidinecarboxylic acid
IUPAC Name: 1-benzhydrylazetidine-3-carboxylic acid | CAS Registry Number: 36476-87-6
Synonyms: 1-benzhydrylazetidine-3-carboxylic acid, 1-(Diphenylmethyl)azetidine-3-carboxylic acid, 1-BENZHYDRYLAZETANE-3-CARBOXYLIC ACID, 1-Benzhydrylazetidine-3-carboxylicacid, 1-benzhydryl-3-azetidinecarboxylic acid, Maybridge3_004072, PubChem10143, ACMC-1AGPN, AC1MC3BD, SureCN85386, Oprea1_775777, KSC222E3P, Jsp006495, CTK1C2237, MolPort-000-003-539, BB_SC-4429, HMS1442J02, HT790, ACN-S003052, ACT01811

Molecular Formula: C17H17NO2Molecular Weight: 267.322380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BRSCYENHLCPOAU-UHFFFAOYSA-N

• 1-Ethyl-3-methyl-1H-pyrazole-5-carboxylic acid
IUPAC Name: 2-ethyl-5-methylpyrazole-3-carboxylate | CAS Registry Number: 50920-65-5
Synonyms: ZINC00120520, CID6927081

Molecular Formula: C7H9N2O2-Molecular Weight: 153.158560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VFMGOJUUTAPPDA-UHFFFAOYSA-M

• 1-Bromo-2,4-dimethoxybenzene
IUPAC Name: 1-bromo-2,4-dimethoxybenzene | CAS Registry Number: 17715-69-4
Synonyms: 4-bromo-3-methoxyanisole, 157554_ALDRICH, Benzene, 1-bromo-2,4-dimethoxy-, EINECS 241-717-0, ZINC00056471, ST5307912, TL8001411

Molecular Formula: C8H9BrO2Molecular Weight: 217.059860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NIUZVSQOXJIHBL-UHFFFAOYSA-N

• 1,4,9,12-Tetraoxadispiro[4,2,4,2]tetradecane
IUPAC Name: 1,4,9,12-tetraoxadispiro[4.2.4^{8}.2^{5}]tetradecane | CAS Registry Number: 183-97-1
Synonyms: Maybridge1_006651, 298743_ALDRICH, 1,4-Cyclohexanedione bis(ethylene ketal), NSC151712, ZINC00083429, ST5410750, 1,4,9,12-Tetraoxadispiro(4.2.4.2)tetradecane, 1,4,9,12-Tetraoxadispiro[4.2.4.2]tetradecane, InChI=1/C10H16O4/c1-2-10(13-7-8-14-10)4-3-9(1)11-5-6-12-9/h1-8H

Molecular Formula: C10H16O4Molecular Weight: 200.231640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YSMVSEYPOBXSOK-UHFFFAOYSA-N

• 3-Amino-1-Boc-pyrrolidine
IUPAC Name: tert-butyl 3-aminopyrrolidine-1-carboxylate | CAS Registry Number: 186550-13-0
Synonyms: 1-Boc-3-aminopyrrolidine, C-3153

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CMIBWIAICVBURI-UHFFFAOYSA-N

• 4-bromo propylbenzene
IUPAC Name: 1-bromo-4-propylbenzene | CAS Registry Number: 588-93-2
Synonyms: 1-Bromo-4-propylbenzene, 319880_ALDRICH, NSC97222, CID136374, ST5405273, InChI=1/C9H11Br/c1-2-3-8-4-6-9(10)7-5-8/h4-7H,2-3H2,1H

Molecular Formula: C9H11BrMolecular Weight: 199.087640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: NUPWGLKBGVNSJX-UHFFFAOYSA-N

• 1,3-Naphthalenediol
IUPAC Name: naphthalene-1,3-diol | CAS Registry Number: 132-86-5
Synonyms: Naphthoresorcinol, Naphthoresoucinol, 1,3-DIHYDROXYNAPHTHALENE, Naphthalene-1,3-diol, 3-Hydroxybenzocyclohexadien-1-one, CCRIS 7896, WLN: L66J BQ DQ, N6250_SIGMA, NSC 115890, 70650_FLUKA, EINECS 205-079-7, CID8601, AIDS154849, 1,3-Naphthalenediol (8CI,9CI), AIDS-154849, AI3-08780, BRN 2044002, NSC115890, ZINC00155677, LS-94566

Molecular Formula: C10H8O2Molecular Weight: 160.169320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XOOMNEFVDUTJPP-UHFFFAOYSA-N

• (S)-1-N-Boc-3-cyanopyrrolidine
IUPAC Name: tert-butyl (3S)-3-cyanopyrrolidine-1-carboxylate | CAS Registry Number: 132945-78-9
Synonyms: (S)-1-Boc-3-cyanopyrrolidine, (S)-1-Boc-3-cyano-pyrrolidine, (S)-1-N-Boc-3-cyano-pyrrolidine, n-t-boc-3(s)-cyanopyrrolidine, tert-butyl (3S)-3-cyanopyrrolidine-1-carboxylate, SBB067144, AG-D-67101, (S)-1-N-BOC-3-CYANOPYRROLIDINE, (S)-3-Cyano-pyrrolidine-1-carboxylic acid tert-butyl ester, 1-pyrrolidinecarboxylic acid, 3-cyano-, 1,1-dimethylethyl ester, (3s)-, (S)-tert-butyl 3-cyanopyrrolidine-1-carboxylate, AC1MBUDG, PubChem11147, SureCN1968766, Jsp002004, CTK4B8262, MolPort-000-140-603, ACT08221, ANW-52358, ZINC02585685

Molecular Formula: C10H16N2O2Molecular Weight: 196.246240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VDDMCMFPUSCJNA-MRVPVSSYSA-N

• (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

• 3,4-Difluorobromobenzene
IUPAC Name: 4-bromo-1,2-difluorobenzene | CAS Registry Number: 348-61-8
Synonyms: 4-Bromo-1,2-difluorobenzene, 1-Bromo-3,4-difluorobenzene, 263478_ALDRICH, JRD-0308, NSC10251, EINECS 206-481-5, ZINC00164754, TL806160, ST5405344, InChI=1/C6H3BrF2/c7-4-1-2-5(8)6(9)3-4/h1-3

Molecular Formula: C6H3BrF2Molecular Weight: 192.988826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YMQPKONILWWJQG-UHFFFAOYSA-N

• 3,4-Methylene Dioxy Benzene
IUPAC Name: 1,3-benzodioxole | CAS Registry Number: 274-09-9
Synonyms: Benzodioxole, 1,3-BENZODIOXOLE, 1,3-Dioxaindan, 1,3-Dioxindan, Methylenedioxybenzene, 1,3-Benzodioxolane, 1,2-Methylenedioxybenzene, 2H-1,3-Benzodioxole, 3,4-Methylenedioxybenzene, o-Methylenedioxybenzene, o-(Methylenedioxy)benzene, (Methylenedioxy)benzene, 1,2-(Methylenedioxy)benzene, Benzene, 1,2-methylenedioxy-, Benzene, 1,2-(methylenedioxy)-, ghl.PD_Mitscher_leg0.1027, 159166_ALDRICH, WLN: T56 BO DO CHJ, CHEBI:38732, EINECS 205-992-0

Molecular Formula: C7H6O2Molecular Weight: 122.121340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FTNJQNQLEGKTGD-UHFFFAOYSA-N

• 1,2-Cyclohexanedione
IUPAC Name: cyclohexane-1,2-dione | CAS Registry Number: 765-87-7
Synonyms: 1,2-CYCLOHEXANEDIONE, 1,2-Dioxocyclohexane, 1,2-Cyclohexadione, Cyclohexane-1,2-dione, Cyclohexan-1,2-dione, CCRIS 6296, C101400_ALDRICH, CHEBI:41674, EINECS 212-155-3, NSC 32950, NSC627435, AIDS132768, AIDS-132768, CID13006, NSC32950, BRN 0507419, CPD0-1349, ZINC01530349, AI3-25042, 1,2-CYCLOHEXANEDIONE,KETONE FORM

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

InChIKey: OILAIQUEIWYQPH-UHFFFAOYSA-N

• 1,2,4,5-Tetrachlorobenzene
IUPAC Name: 1,2,4,5-tetrachlorobenzene | CAS Registry Number: 95-94-3
Synonyms: s-Tetrachlorobenzene, Benzene tetrachloride, Tetrachlorobenzene, 1,2,4,5-TETRACHLOROBENZENE, Benzene, tetrachloro-, Benzene, 1,2,4,5-tetrachloro-, RCRA waste no. U207, RCRA waste number U207, TETRACHLOROBENZENES, Maybridge1_002304, CCRIS 766, WLN: GR BG DG EG, 1,2,4,5-Tetrachlorbenzol, HSDB 2733, MLS001055490, DivK1c_001056, CID7270, 131857_ALDRICH, 34379_RIEDEL, 442219_SUPELCO

Molecular Formula: C6H2Cl4Molecular Weight: 215.892080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JHBKHLUZVFWLAG-UHFFFAOYSA-N

• (R)-3-Hydroxypyrrolidine hydrochloride
IUPAC Name: (3R)-pyrrolidin-3-ol;hydrochloride | CAS Registry Number: 104706-47-0
Synonyms: (R)-(-)-3-Pyrrolidinol hydrochloride, (R)-3-Hydroxypyrrolidine HCl, (r)-pyrrolidin-3-ol hydrochloride, (R)-3-Pyrrolidinol hydrochloride, (3R)-pyrrolidin-3-ol hydrochloride, r-3-hydroxypyrrolidine-hcl, 3r-pyrrolidinol hydrochloride, (r)-(+)-3-pyrrolidinol hydrochloride, (3r)-3-hydroxypyrrolidine hydrochloride, (R)-(-)-3-Hydroxypyrrolidine Hydrochloride, PubChem7469, SureCN16919, AC1MC06G, AC1Q3DR5, KSC491E6J, 430722_ALDRICH, Jsp000461, CTK3J1264, MolPort-000-004-317, (r)-pyrrolidine-3-ol hydrochloride

Molecular Formula: C4H10ClNOMolecular Weight: 123.581300 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: QPMSJEFZULFYTB-PGMHMLKASA-N

• (-)-α-Pinene
IUPAC Name: (1S,5S)-4,7,7-trimethylbicyclo[3.1.1]hept-3-ene | CAS Registry Number: 7785-26-4
Synonyms: (-)-alpha-Pinene, ALPHA-PINENE (DL), (1S,5S)-pin-2-ene, (-)-(1S,5S)-alpha-pinene, CHEBI:28660, BB_NC-0755, CPD-4892, (1S,5S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene, 2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-bicyclo[3.1.1]hept-2-ene, C06308, Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene, Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (1S,5S)-, InChI=1/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H, 80-56-8

Molecular Formula: C10H16Molecular Weight: 136.234040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GRWFGVWFFZKLTI-IUCAKERBSA-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-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-Acetonaphthone
IUPAC Name: 1-naphthalen-1-ylethanone | CAS Registry Number: 941-98-0
Synonyms: 1'-Acetonaphthone, 1-Acetylnaphthalene, 1-Acetonaphthalene, alpha-Acetonaphthone, Methyl 1-naphthyl ketone, alpha-Acetylnaphthalene, 1-Naphthyl methyl ketone, .alpha.-Acetonaphthone, alpha-Naphthyl methyl ketone, 1-(1-Naphthalenyl)ethanone, Ethanone, 1-(1-naphthalenyl)-, Methyl alpha-naphthyl ketone, .alpha.-Acetylnaphthalene, 1-(1-Naphthyl)ethanone, ALPHA-NAPHTHYLKETONE, ghl.PD_Mitscher_leg0.724, .alpha.-Naphthyl methyl ketone, Methyl .alpha.-naphthyl ketone, 276766_ALDRICH, NSC 7659

Molecular Formula: C12H10OMolecular Weight: 170.207200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QQLIGMASAVJVON-UHFFFAOYSA-N

• 1-Bromo 3 5-Difluorbenzene
IUPAC Name: 1-bromo-3,5-difluorobenzene | CAS Registry Number: 461-96-1
Synonyms: 1-Bromo-3,5-difluorobenzene, 290165_ALDRICH, ZINC00164583, JRD-0215, CID136313, ST5405331, TL8003201, InChI=1/C6H3BrF2/c7-4-1-5(8)3-6(9)2-4/h1-3

Molecular Formula: C6H3BrF2Molecular Weight: 192.988826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JHLKSIOJYMGSMB-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

• 1,8-Diazabicyclo(5.4.0)undec-7-ene
IUPAC Name: 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine | CAS Registry Number: 6674-22-2
Synonyms: MLS000039793, 139009_ALDRICH, 33482_FLUKA, 1,5-Diazabicyclo[5.4.0]undec-5-ene, EINECS 229-713-7, 1,8-Diazabicyclo[5.4.0]undec-7-ene, NSC111184, NSC 111184, 1,5-Diazabicyclo(5.4.0)undec-5-ene, SMR000036948, ST5308548, Pyrimido[1,2-a]azepine, 2,3,4,6,7,8,9,10-octahydro-, 2,3,4,6,7,8,9,10-Octahydropyrimidol[1,2-a]azepine, 2,3,4,6,7,8,9,10-Octahydropyrimido(1,2-alpha)azepine, Pyrimido(1,2-a)azepine, 2,3,4,6,7,8,9,10-octahydro-, 2,3,4,6,7,8,9,10-Octahydropyrimido[1,2-.alpha.]azepine, DBU, 31171-04-7, 41015-70-7, 51301-56-5

Molecular Formula: C9H16N2Molecular Weight: 152.236740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GQHTUMJGOHRCHB-UHFFFAOYSA-N

• 2,2-Diphenyl-L-Prolinol
IUPAC Name: di(phenyl)-[(2S)-pyrrolidin-1-ium-2-yl]methanol | CAS Registry Number: 112068-01-6
Synonyms: ZINC03632772

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

InChIKey: OGCGXUGBDJGFFY-INIZCTEOSA-O

• 2-Acetyl Benzimidazole
IUPAC Name: 1-(1H-benzimidazol-2-yl)ethanone | CAS Registry Number: 939-70-8
Synonyms: 2-Acetylbenzimidazole, 1-(1H-Benzoimidazol-2-yl)-ethanone, ZERO/009163, ZINC00260175, Ethanone, 1-(1H-benzimidazol-2-yl)-, BAS 00619146, EC-000.1513, EU-0063375, InChI=1/C9H8N2O/c1-6(12)9-10-7-4-2-3-5-8(7)11-9/h2-5H,1H3,(H,10,11

Molecular Formula: C9H8N2OMolecular Weight: 160.172620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UYFMRVDIXXOWLR-UHFFFAOYSA-N

• 1,4-Benzenediboronic acid
IUPAC Name: (4-boronophenyl)boronic acid | CAS Registry Number: 4612-26-4
Synonyms: p-Benzenediboronic acid, p-Phenylenediboronic acid, Benzene-1,4-diboronic acid, 1,4-Phenylenebisboronic acid, 417130_ALDRICH, NSC25410, CID230478, B1435G1, NCGC00092017-01, ST5405947

Molecular Formula: C6H8B2O4Molecular Weight: 165.747320 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: BODYVHJTUHHINQ-UHFFFAOYSA-N

• 1-Cyanoethyl-2-Methylimidazole
IUPAC Name: 3-(2-methylimidazol-1-yl)propanenitrile | CAS Registry Number: 23996-55-6
Synonyms: ZERO/001890, 1-Cyanoethyl-2-methylimidazole, ALBB-004609, CID90328, EINECS 245-976-0, 2-Methyl-1H-imidazole-1-propiononitrile, 1H-Imidazole-1-propanenitrile, 2-methyl-, 3-(2-methyl-1H-imidazol-1-yl)propanenitrile

Molecular Formula: C7H9N3Molecular Weight: 135.166460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SESYNEDUKZDRJL-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

• 4-(4-Fluorophenyl)butanoic Acid
IUPAC Name: 4-(4-fluorophenyl)butanoic acid | CAS Registry Number: 589-06-0
Synonyms: 4-(p-Fluorophenyl)butyric acid, NSC409583, 4-(4-Fluoro-phenyl)-butyric acid, CID68524, EINECS 209-631-8, BBV-183168, BAS 13704771

Molecular Formula: C10H11FO2Molecular Weight: 182.191543 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XVQYBBYOYJXQBF-UHFFFAOYSA-N


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