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2A Pharmachem USA

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Profile: 2A Pharmachem USA provides fine chemicals, pharmaceutical intermediates, and active pharmaceutical ingredients. We supply products to pharmaceutical & biotech companies, research organizations and university labs. We are engaged in the marketing development, sales, technical support and service. We specialize in the pharmaceutical and biotech industries. Our active pharmaceutical ingredients include sulfacetamide sodium, phenylephrine hydrogentartrate, d-tyrosine, sulfinpyrazone, isopulegol, ketamine, and trans-chlordane.

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• 1-(4-Fluorophenyl)-2-(1H-1,2,4-triazole-1-yl)ethanone
IUPAC Name: 1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone | CAS Registry Number: 58905-21-8
Synonyms: SureCN673406, 1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone, CHEMBL2063491, CTK1G7940, MolPort-003-823-829, ANW-60103, SBB093462, ZINC02524690, AKOS009992928, AG-G-09033, AK-10039, KB-09091, FT-0640566, A832067, 1-(4-fluorophenyl)-2-(1,2,4-triazolyl)ethan-1-one, 1-(4-Fluorophenyl)-2-(1h-[1,2,4]TRIAZOLE-1-yl)ethanone, 1-(4-FLUOROPHENYL)-2-(1H-1,2,4-TRIAZOL-1-YL)ETHANONE;1-(4-FLUOROPHENYL)-2-(1H-1,2,4-TRIAZOLE-1-YL)ETHANONE;4''-Fluoro-2-(1H-1,2,4-triazol-1-)-ylacetophenone;1-(4-FLUOROPHENYL)-2-(1H-1,2,4-TRIAZOLE-1-YL)ETHANONE, 95+%

Molecular Formula: C10H8FN3OMolecular Weight: 205.188423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IKOAKIRZMHXFFT-UHFFFAOYSA-N

• 1-(3-Hydroxyphenyl)piperazine
IUPAC Name: 3-piperazin-1-ylphenol | CAS Registry Number: 59817-32-2
Synonyms: 3-(piperazin-1-yl)phenol, 3-piperazin-1-ylphenol, 3-(1-Piperazino)phenol, 3-(1-piperazinyl)phenol, 1-(3-Hydroxyphenyl) piperazine, 1-(3-HYDROXYPHENYL)-PIPERAZINE, ST094925, 3-piperazinylphenol, AC1MC5XX, 3-piperazin-1-yl-phenol, ACMC-1AXE0, SureCN788160, Oprea1_613831, n-(3-hydroxyphenyl)piperazine, 651672_ALDRICH, AC1Q790F, CTK8C6245, MolPort-000-156-374, STL373272, AKOS001393913

Molecular Formula: C10H14N2OMolecular Weight: 178.230960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AYGYICRITMSJOC-UHFFFAOYSA-N

• (R)-(-)-1,3-Butanediol
IUPAC Name: butane-1,3-diol | CAS Registry Number: 6290-03-5
Synonyms: 1,3-BUTANEDIOL, Butane-1,3-diol, Butylene glycol, 1,3-Butylene glycol, 1,3-Dihydroxybutane, beta-Butylene glycol, .beta.-Butylene glycol, Methyltrimethylene glycol, Caswell No. 128GG, 1-Methyl-1,3-propanediol, (RS)-1,3-Butandiol, ()-1,3-Butanediol, 1,3-Butandiol [German], 1,3-butanediol, DL-, 1,3-Butanediol, (R)-, 1,3-Butanediol, (S)-, 1,3-Butylenglykol [German], BUTANEDIOL,1,3-, HSDB 153, (S)-(+)-1,3-Butanediol

Molecular Formula: C4H10O2Molecular Weight: 90.121000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PUPZLCDOIYMWBV-UHFFFAOYSA-N

• (R)-2-(4-Ethyl-2,3-dioxopiperazine-1-carboxamido)-2-phenylacetic acid
IUPAC Name: (2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetic acid | CAS Registry Number: 63422-71-9
Synonyms: 472891_ALDRICH, EINECS 264-133-8, (R)-(((4-Ethyl-2,3-dioxopiperazin-1-yl)carbonyl)amino)phenylaceticacid, (R)-(−)-alpha-[[(4-Ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]benzeneacetic acid

Molecular Formula: C15H17N3O5Molecular Weight: 319.312580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: JQEHQELQPPKXRR-LLVKDONJSA-N

• 4-Isopropylacetophenone
IUPAC Name: 1-(4-propan-2-ylphenyl)ethanone | CAS Registry Number: 645-13-6
Synonyms: Cuminone, Acetylcumene, p-, p-Isopropylacetophenone, Acetophenone, 4'-isopropyl-, 4'-Isopropylacetophenone, 4-ISOPROPYLACETOPHENONE, Isopropylacetylbenzene, p-, FEMA No. 2927, Methyl p-isopropylphenyl ketone, NSC9165, Ethanone, 1-[4-(1-methylethyl)phenyl]-, NSC 9165, EINECS 211-433-1, ZINC01648505, Acetophenone, 4'-isopropyl- (8CI), 1-(4-(1-Methylethyl)phenyl)ethanone, 1-(4-(1-Methylethyl)phenyl)ethan-1-one, Ethanone, 1-(4-(1-methylethyl)phenyl)-, AI3-15527, ST5407156

Molecular Formula: C11H14OMolecular Weight: 162.228260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PDLCCNYKIIUWHA-UHFFFAOYSA-N

• (S)-3-Acetylthio-2-methylpropionyl-L-proline
IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)pyrrolidine-2-carboxylic acid | CAS Registry Number: 64838-55-7
Synonyms: EINECS 265-250-7, (S)-1-(3-(Acetylthio)-2-methyl-1-oxopropyl)-L-proline

Molecular Formula: C11H17NO4SMolecular Weight: 259.321980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZNQRGUYIKSRYCI-UHFFFAOYSA-N

• (+/-)-3-Aminohomopiperidine
IUPAC Name: azepan-3-amine | CAS Registry Number: 69154-03-6
Synonyms: 3-Aminohomopiperidine, Azepan-3-amine, (+/-)-3-amino-homopiperidine, azepan-3-ylamine, Hexahydro-1H-azepin-3-amine, rac-azepan-3-amine, 3-amino-homopiperidine, AG-G-68841, (R)-3-AMINO-HEXAHYDRO-1H-AZEPIN, AC1MBTL8, SureCN913514, (+/-)-3-aminohomopiperidine, 1H-Azepin-3-amine,hexahydro-, CTK5C9157, MolPort-000-151-093, ACT01819, ANW-51510, SBB069776, AKOS011935651, AB11528

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

InChIKey: WJUBYASTGWKFHK-UHFFFAOYSA-N

• (S)-Glycidyl tosylate
IUPAC Name: [(2S)-oxiran-2-yl]methyl 4-methylbenzenesulfonate | CAS Registry Number: 70987-78-9
Synonyms: Glycidyl tosylate, (+)-Glycidyl tosylate, (2S)-(+)-Glycidyl tosylate, CCRIS 6400, (2S)-()-Glycidyl tosylate, 540129_ALDRICH, (S)-()-Glycidyl p-toluenesulfonate, BRN 3592143, CID153296, NSC636971, ZINC01624985, NCI60_012248, LS-101059, Oxiranemethanol, 4-methylbenzenesulfonate, (S)-, ST5319392, TL8004999, (S)-()-Oxirane-2-methanol p-toluenesulfonate, 5-17-03-00047 (Beilstein Handbook Reference)

Molecular Formula: C10H12O4SMolecular Weight: 228.264880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: NOQXXYIGRPAZJC-VIFPVBQESA-N

• (Hexafluoro-2-hydroxyisopropyl)benzene
IUPAC Name: 1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-ol | CAS Registry Number: 718-64-9
Synonyms: Hexafluoro-2-phenyl isopropanol, 107565_ALDRICH, Hexafluoro-2-phenyl-2-propanol, Bis(trifluoromethyl)phenylcarbinol, NSC96337, EINECS 211-943-4, ZINC00157910, 1,1,1,3,3,3-Hexafluoro-2-phenyl-2-propanol, 2,2,2,2',2',2'-Hexafluorocumyl alcohol, alpha,alpha-Bis(trifluoromethyl)benzyl alcohol, TL8005033, Benzenemethanol, alpha,alpha-bis(trifluoromethyl)-, Benzyl alcohol, .alpha.,.alpha.-bis(trifluoromethyl)-, Benzenemethanol, .alpha.,.alpha.-bis(trifluoromethyl)-

Molecular Formula: C9H6F6OMolecular Weight: 244.133759 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: IZPIZCAYJQCTNG-UHFFFAOYSA-N

• 1,4-Bis(diphenylphosphino)butane
IUPAC Name: 4-di(phenyl)phosphanylbutyl-di(phenyl)phosphane | CAS Registry Number: 7688-25-7
Synonyms: dppb, Bis(1,4-diphenylphosphino)butane, 261947_ALDRICH, 14805_FLUKA, 1,4-Bis[diphenylphosphino]butane, EINECS 231-698-7, Butane-1,4-diylbis(diphenylphosphine), Phosphine, 1,4-butanediylbis(diphenyl-, [4-(Diphenylphosphino)butyl](diphenyl)phosphine

Molecular Formula: C28H28P2Molecular Weight: 426.469442 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BCJVBDBJSMFBRW-UHFFFAOYSA-N

• 1,8-Dibromoperfluorooctane
IUPAC Name: 1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane | CAS Registry Number: 812-58-8
Synonyms: 1,8-dibromohexadecafluorooctane, 1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane, ACMC-209pl2, AC1MC6B6, CTK5E8631, MolPort-000-153-901, ANW-37428, PC2268, AKOS015833869, KB-87308, AB1011068, D3587, FT-0607041, A840077, I14-25869, 1,8-bis(bromanyl)-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecakis(fluoranyl)octane, Octane,1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-

Molecular Formula: C8Br2F16Molecular Weight: 559.868051 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 16

InChIKey: LYRJPHOHVRHNQH-UHFFFAOYSA-N

• (4-Amino-2,3-difluorophenyl)acetic acid
IUPAC Name: 2-(4-amino-2,3-difluorophenyl)acetic acid | CAS Registry Number: 835912-66-8
Synonyms: 2-(4-amino-2,3-difluorophenyl)acetic acid, 4-Amino-2,3-difluorobenzoacetic acid, 4-Amino-2,3-difluoro-1-benzeneacetic acid, AC1MBTHT, CTK5F0887, AKOS006295492, AB23108, AG-H-33615, AC-14789, KB-01691, Benzeneacetic acid,4-amino-2,3-difluoro-, (4-Amino-2,3-difluoro-phenyl)-acetic acid, FT-0644893, A840606, 2-[4-azanyl-2,3-bis(fluoranyl)phenyl]ethanoic acid, 4-AMINO-2,3-DIFLUORO-1-BENZENEACETIC ACID;4-AMINO-2,3-DIFLUOROBENZOACETIC ACID;(4-AMINO-2,3-DIFLUOROPHENYL)ACETIC ACID;1-(4-Amino-2,3-difluoro-phenyl)-acetic acid

Molecular Formula: C8H7F2NO2Molecular Weight: 187.143486 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: PGVRQGJEDKBSET-UHFFFAOYSA-N

• (R)-1-(Thiophen-2-yl)ethanol
IUPAC Name: (1R)-1-thiophen-2-ylethanol | CAS Registry Number: 86527-10-8
Synonyms: (1R)-1-(2-Thienyl)ethanol, (R)-1-(thiophen-2-yl)ethanol, AC1Q29CP, SureCN4099433, 06674_FLUKA, CTK5F6911, MolPort-009-198-003, ZINC06037199, (1R)-|A-Methyl-2-thiophenemethanol, (1R)-1-(thiophen-2-yl)ethan-1-ol, (1R)-alpha-Methyl-2-thiophenemethanol, 2-Thiophenemethanol,a-methyl-, (aR)-, AG-B-73616, AK-36610, KB-02692, FT-0642046, EN300-66136

Molecular Formula: C6H8OSMolecular Weight: 128.192120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WUNFIVTVJXZDDJ-RXMQYKEDSA-N

• (-)-Sparteine
Synonyms: Sparteine, lupinidine, Lupinidin, Spartein, (-)-Lupinidine, L-SPARTEINE, Prestwick_426, Sparteine (-), Prestwick3_000618, Sparteine (6CI,8CI), BSPBio_000556, MLS000028889, BPBio1_000612, CHEBI:28827, 6beta,7alpha,9alpha,11alpha-Pachycarpine, NCGC00142614-01, SMR000059203, TL8005816, 6-beta,7-alpha,9-alpha,11-alpha-Pachycarpine, C10783

Molecular Formula: C15H26N2Molecular Weight: 234.380340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SLRCCWJSBJZJBV-ZQDZILKHSA-N

• (S)-1-Benzyl-3-hydroxypiperidine
IUPAC Name: (3S)-1-benzylpiperidin-3-ol | CAS Registry Number: 91599-79-0
Synonyms: (3s)-1-benzylpiperidin-3-ol, (S)-1-benzylpiperidin-3-ol, (S)-1-N-Benzyl-3-hydroxy-piperidine, (S)-1-Benzyl-piperidinol, (S)-1-Benzyl-3-piperidinol, (s)-n-benzyl-3-hydroxypiperidine, AC1LEWRM, PubChem13102, AC1Q59UN, SureCN5205368, 28964_ALDRICH, (s)-1-benzyl-piperidin-3-ol, 28964_FLUKA, CTK5H0184, MolPort-001-768-424, KST-1A8931, ACT09001, (s)-1-n-benzyl-3-hydroxypiperidine, ANW-60758, AR-1A4462

Molecular Formula: C12H17NOMolecular Weight: 191.269480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UTTCOAGPVHRUFO-LBPRGKRZSA-N

• (S)-N-boc-3-Amino-Pyrrolidine
IUPAC Name: tert-butyl (3S)-3-aminopyrrolidine-1-carboxylate | CAS Registry Number: 147081-44-5
Synonyms: (s)-1-boc-3-aminopyrrolidine, (S)-3-Amino-1-N-BOC-pyrrolidine, (S)-(-)-1-Boc-3-aminopyrrolidine, (S)-3-Amino-N-Boc-pyrrolidine, s-bocap, (S)-3-Amino-1-Boc-pyrrolidine, (s)-(-)-boc-3-aminopyrrolidine, (S)-1-(tert-Butoxycarbonyl)-3-aminopyrrolidine, (S)-1-N-Boc-3-Aminopyrrolidine, (s)-tert-butyl 3-aminopyrrolidine-1-carboxylate, tert-butyl (3S)-3-aminopyrrolidine-1-carboxylate, (S)-(-)-1-tert-Butoxycarbonyl-3-aminopyrrolidine, (s)-(-)-n-boc-3-aminopyrrolidine, (s)-(-)-1-tboc-3-aminopyrrolidine, (3S)-(-)-1-(tert-Butoxycarbonyl)-3-aminopyrrolidine, AG-D-91847, (3S)-(-)-1-Boc-3-aminopyrrolidine, (s)-n-tert-butoxycarbonyl-3-aminopyrrolidine, ST50825256, (s)-3-amino-1-tert-butoxycarbonylpyrrolidine

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

InChIKey: CMIBWIAICVBURI-ZETCQYMHSA-N

• 1,3-Dihydroxy methyl Benzene
IUPAC Name: [3-(hydroxymethyl)phenyl]methanol | CAS Registry Number: 626-18-6
Synonyms: 1,3-Benzenedimethanol, m-Xylene glycol, Ambap7421, m-Xylene-alpha,alpha'-diol, 196533_ALDRICH, EINECS 210-934-2, ZINC00406981, TL8004211

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YWMLORGQOFONNT-UHFFFAOYSA-N

• 1,3-Dimethyl-5-Pyrazolone
IUPAC Name: 2,5-dimethyl-4H-pyrazol-3-one | CAS Registry Number: 2749-59-9
Synonyms: NSC304, 1,3-Dimethyl-5-pyrazolone, 1,3-Dimethyl-5-pyrazolinone, 2-Pyrazolin-5-one, 1,3-dimethyl-, CID17673, EINECS 220-389-2, ZINC00162113, 3H-Pyrazol-3-one, 2,4-dihydro-2,5-dimethyl-, 2,4-DIHYDRO-2,5-DIMETHYL-3H-PYRAZOL-3-ONE

Molecular Formula: C5H8N2OMolecular Weight: 112.129820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NDELSWXIAJLWOU-UHFFFAOYSA-N

• 4-Hydroxyphenyl piperazine
IUPAC Name: 4-piperazin-1-ylphenol | CAS Registry Number: 56621-48-8
Synonyms: 4-Piperazinophenol, p-(1-Piperazinyl)phenol, Oprea1_539482, 1-(4-Hydroxyphenyl)piperazine, 1-(4-Hydroxyphenyl)-piperazine, 77732_FLUKA, EINECS 260-289-6, ST5405636

Molecular Formula: C10H14N2OMolecular Weight: 178.230960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GPEOAEVZTOQXLG-UHFFFAOYSA-N

• 2,3-Dichloro-5,6-Dicyano-1,4-Benzoquinone
IUPAC Name: 4,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile | CAS Registry Number: 84-58-2
Synonyms: Dichlorodicyanoquinone, Dichlorodicyano-p-benzoquinone, Dichlorodicyanobenzoquinone, 2,3-Dichloro-5,6-dicyanoquinone, CCRIS 7154, D60400_ALDRICH, 1,2-Dichloro-4,5-dicyanobenzoquinone, 2,3-Dichloro-5,6-dicyanobenzoquinone, 2,3-Dicyano-5,6-dichlorobenzoquinone, 2,3,5,6-Dichlorodicyanoquinone, EINECS 201-542-2, 2,3-Dichloro-5,6-dicyano-p-quinone, AIDS218263, 2,3-Dichloro-5,6-dicyano-p-benzoquinone, NSC 401087, AIDS-218263, NSC401087, 5,6-Dichloro-2,3-dicyano-p-benzoquinone, 5,6-Dicyano-2,3-dichloro-p-benzoquinone, 1,4-CYCLOHEXADIENE-1,2-DICARBONITRILE, 4,5-DICHLORO-3,6-DIOXO-

Molecular Formula: C8Cl2N2O2Molecular Weight: 227.003800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HZNVUJQVZSTENZ-UHFFFAOYSA-N

• 1,3-Propane Sultone
IUPAC Name: oxathiolane 2,2-dioxide | CAS Registry Number: 1120-71-4
Synonyms: Propane sultone, Propanesultone, 1,3-Propanesultone, .gamma.-Propane sultone, 1,2-Oxathiolane, 2,2-dioxide, 1,3-PROPANE SULTONE, RCRA waste no. U193, RCRA waste number U193, WLN: T5OSWTJ, CCRIS 535, 1,2-oxathiolane 2,2-dioxide, 1,2-Oxathrolane 2,2-dioxide, 3-Hydroxythietane-1,1-Dioxide, P50706_ALDRICH, HSDB 1673, 291250_ALDRICH, 81815_FLUKA, EINECS 214-317-9, NSC 42386, NSC42386

Molecular Formula: C3H6O3SMolecular Weight: 122.142940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: FSSPGSAQUIYDCN-UHFFFAOYSA-N

• 1,2,3-Trimethylbenzene
IUPAC Name: 1,2,3-trimethylbenzene | CAS Registry Number: 526-73-8
Synonyms: Hemimellitene, Hemellitol, Hemimellitol, Methylxylene, Trimethylbenzene, Trimethyl benzene, 1,2,3-TRIMETHYLBENZENE, Benzene, trimethyl-, Benzene, 1,2,3-trimethyl-, TRIMETHYLBENZENES, Hemimellitene, 90.5%, Trimethylbenzene (all isomers), T73202_ALDRICH, HSDB 6830, 1,2,3-Trimethylbenzene, 90.5%, Trimethyl benzene (mixed isomers), 45935_RIEDEL, CCRIS 8145, NSC 5167, WLN: 1R B1 C1

Molecular Formula: C9H12Molecular Weight: 120.191580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FYGHSUNMUKGBRK-UHFFFAOYSA-N

• 1,6-Divinylperfluorohexane
IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8-dodecafluorodeca-1,9-diene | CAS Registry Number: 1800-91-5
Synonyms: EINECS 217-288-0, CID102163, 3,3,4,4,5,5,6,6,7,7,8,8-Dodecafluorodeca-1,9-diene

Molecular Formula: C10H6F12Molecular Weight: 354.135478 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 12

InChIKey: PDFSXHZXNZCKNF-UHFFFAOYSA-N

• (2,6,6-Trimethyl-2-Hydroxycyclohexylidene)acetic Acid Lactone
IUPAC Name: 4,4,7a-trimethyl-6,7-dihydro-5H-1-benzofuran-2-one | CAS Registry Number: 17092-92-1
Synonyms: DIHYDROACTINIDIOLIDE, Actinidiolide, dihydro-, CID27209, EINECS 239-390-4, NSC357087, NSC 357087, 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-, (2,6,6-Trimethyl-2-hydroxycyclohexylidene)acetic acid lactone, 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-, (R)-, 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-, (S)-, 5,6,7,7a-Tetrahydro-4,4,7a-trimethyl-2(4H)-benzofuranone, 5,6,7,7a-Tetrahydro-4,4,7a-trimethylbenzofuran-2(4H)-one, 2-Hydroxy-2,6,6-trimethylcyclohexylideneacetic acid gamma-lactone, 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl- (VAN) (8CI), 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-, (R)- (9CI), 15356-74-8, 19432-05-4

Molecular Formula: C11H16O2Molecular Weight: 180.243540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IMKHDCBNRDRUEB-UHFFFAOYSA-N

• 1 4-Difluorobenzene
IUPAC Name: 1,4-difluorobenzene | CAS Registry Number: 540-36-3
Synonyms: p-Difluorobenzene, Benzene, p-difluoro-, para-Difluorobenzene, 1,4-DIFLUOROBENZENE, Benzene, 1,4-difluoro-, 1,4-Difluorbenzol, 1,4-Difluoro-benzene, WLN: FR DF, D102202_ALDRICH, 442249_SUPELCO, 36910_FLUKA, CHEBI:38585, EINECS 208-742-9, NSC 10286, Benzene, 1,4-difluoro- (9CI), JRD-0119, NSC10286, ZINC00164664, LS-29836, SB 01462

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

InChIKey: QUGUFLJIAFISSW-UHFFFAOYSA-N

• 1,2,3,-Trichloropropane
IUPAC Name: 1,2,3-trichloropropane | CAS Registry Number: 96-18-4
Synonyms: Trichlorohydrin, Allyl trichloride, Trichloropropane, Glycerol trichlorohydrin, 1,2,3-TRICHLOROPROPANE, Glyceryl trichlorohydrin, Propane, 1,2,3-trichloro-, glyceroltrichlorohydrin, Glycerin trichlorohydrin, WLN: G1YG1G, CCRIS 5874, Trichloropropane, 1,2,3-, HSDB 1340, 47794_SUPELCO, 110124_ALDRICH, 46269_RIEDEL, NCI-C60220, EINECS 202-486-1, NSC 35403, BB_SC-0499

Molecular Formula: C3H5Cl3Molecular Weight: 147.430800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CFXQEHVMCRXUSD-UHFFFAOYSA-N

• 1,3-Dimethyl-2-imidazolidinone
IUPAC Name: 1,3-dimethylimidazolidin-2-one | CAS Registry Number: 80-73-9
Synonyms: Karbomos TsEM, Rhonite 1, Dimethylethyleneurea, Dimethyl imidazolidinone, N,N'-Dimethylethyleneurea, DMEU, 1,3-Dimethylethyleneurea, N,N'-Dimethylimidazolidone, N,N'-Dimethylimidazolidinone, 1,3-Dimethylimidazolidin-2-one, 1,3-Dimethyl-2-imidazolidone, 2-IMIDAZOLIDINONE, 1,3-DIMETHYL-, 193453_ALDRICH, 40725_FLUKA, 40727_FLUKA, EINECS 201-304-8, CID6661, BRN 0108808, SBB008346, 2-IMIDAZOLIDONE,1,3-DIMETHYL

Molecular Formula: C5H10N2OMolecular Weight: 114.145700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CYSGHNMQYZDMIA-UHFFFAOYSA-N

• 1,7-Dihydroxy Naphthalene
IUPAC Name: naphthalene-1,7-diol | CAS Registry Number: 575-38-2
Synonyms: 1,7-Naphthalenediol, 1,7-Dihydroxynaphthalene, Naphthalene-1,7-diol, CCRIS 7895, 535486_ALDRICH, 37750_FLUKA, EINECS 209-383-0, NSC 62686, NSC62686, ZINC00388552, C.I. 76635, LS-94570

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

InChIKey: ZUVBIBLYOCVYJU-UHFFFAOYSA-N

• 4,4,4-Trifluoro-1 (4-Methylphenyl)-Butane-1,3-Dione
IUPAC Name: 4,4,4-trifluoro-1-(4-methylphenyl)butane-1,3-dione | CAS Registry Number: 720-94-5
Synonyms: TOS-BB-0661, ALBB-006417, STK298732, TL8005050, 1,3-Butanedione, 4,4,4-trifluoro-1-p-tolyl-, 4,4,4-trifluoro-1-(4-methylphenyl)butane-1,3-dione, l-(4-Methylphenyl)-4,4,4-trifluorobutane-1,3-dione, Benzene, 1-(3-trifluoromethyl-3-hydroxypropenoyl)-4-methyl-

Molecular Formula: C11H9F3O2Molecular Weight: 230.183170 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: WRZMHTIRFOFFPY-UHFFFAOYSA-N

• 1,8-Octane diisothiocyanate
IUPAC Name: 1,8-diisothiocyanatooctane | CAS Registry Number: 56312-14-2
Synonyms: 1,8-Diisothiocyanatooctane, 1,8-Octanediisothiocyanate, CID143346

Molecular Formula: C10H16N2S2Molecular Weight: 228.377440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LVGANCPXXODGKA-UHFFFAOYSA-N

• (+/-)-Methadone-D3
IUPAC Name: 1,1,1-trideuterio-6-(dimethylamino)-4,4-diphenylheptan-3-one | CAS Registry Number: 60263-63-0
Synonyms: DL-Methadone-d3 solution, DL-Methadone-(heptyl-1,1,1-d3) solution, FT-0640678, DL-6-Dimethylamino-4,4-diphenyl-3-heptanone-1,1,1-d3 solution

Molecular Formula: C21H27NOMolecular Weight: 312.463665 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: USSIQXCVUWKGNF-FIBGUPNXSA-N

• (S)-1-Boc-3-aminopiperidine
IUPAC Name: tert-butyl (3S)-3-aminopiperidine-1-carboxylate | CAS Registry Number: 625471-18-3
Synonyms: (S)-3-Amino-1-N-BOC-piperidine, (S)-3-Amino-1-Boc-piperidine, (S)-(+)-3-Amino-1-Boc-piperidine, (s)-n-boc-3-aminopiperidine, (s)-1-boc-3-amniopiperidine, (S)-1-Boc-3-piperidinamine, (s)-3-amino-n-tboc-piperidine, tert-butyl (3S)-3-aminopiperidine-1-carboxylate, (3s)-3-aminopiperidine, n1-boc protected, (S)-3-Amino-1-tert-butoxycarbonylpiperidine, (s)-tert-butyl 3-aminopiperidine-carboxylate, (3S)-3-Amino-1-(tert-butoxycarbonyl)piperidine, tert-Butyl (S)-3-amino-1-piperidinecarboxylate, (s)-3-amino-piperidine-1-carboxylic acid tert-butyl ester, 1-piperidinecarboxylic acid, 3-amino-, 1,1-dimethylethyl ester, (3s)-, (s)-tert-butyl 3-aminopiperidine-1-carboxylate, (s)3-amino-1-boc-piperidine, (R)-3-Amino-N-Boc-piperidine, tert-Butyl 3-amino-1-piperidinecarboxylate, (r)-tert-butyl 3-aminopiperidine-1-carboxylate

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

InChIKey: AKQXKEBCONUWCL-QMMMGPOBSA-N

• 1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone
IUPAC Name: 1-(4-chlorophenyl)-4,4-dimethylpentan-3-one | CAS Registry Number: 66346-01-8
Synonyms: HWG 1608-Alkylketon, ZINC02562558, CID94617, 3-Pentanone, 1-(4-chlorophenyl)-4,4-dimethyl-, LS-101927, TL8004699, 1-(4-chlorophenyl)-4,4-dimethylpentan-3-one, T5379927

Molecular Formula: C13H17ClOMolecular Weight: 224.726480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ILQGIJDYSLHIOX-UHFFFAOYSA-N

• (4-Nitrophenyl)piperazin-1-yl-methanone
IUPAC Name: (4-nitrophenyl)-piperazin-1-ylmethanone | CAS Registry Number: 72141-41-4
Synonyms: 1-(4-Nitrobenzoyl)piperazine, (4-nitrophenyl)piperazin-1-yl-methanone, (4-nitrophenyl)(piperazino)methanone, (4-Nitrophenyl)(piperazin-1-yl)methanone, (4-Nitro-phenyl)-piperazin-1-yl-methanone, 4-nitrophenyl piperazinyl ketone, AC1LBYOW, BAS 01375857, Maybridge1_001363, nitrophenylpiperazinomethanone, SureCN2710229, Oprea1_856236, Oprea1_857687, 1-(4-nitrobenzoyl)-piperazine, CHEMBL327793, CTK5D5604, HMS545F21, MolPort-000-157-783, BTB06396, CCG-51542

Molecular Formula: C11H13N3O3Molecular Weight: 235.239220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HIQSQKKHPVVUEJ-UHFFFAOYSA-N

• 1-[(Benzyloxy)carbonyl]piperidine-3-carboxylic acid
IUPAC Name: 1-(phenylmethoxycarbonyl)piperidine-3-carboxylic acid | CAS Registry Number: 78190-11-1
Synonyms: Oprea1_486455, NSC34059, SBB003078

Molecular Formula: C14H17NO4Molecular Weight: 263.289080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: FFLPIVZNYJKKDM-UHFFFAOYSA-N

• (E)Ethyl4-(3,4-dimethoxyphenyl)-4-oxo-2-butenoate
IUPAC Name: (E)-4-(3,4-dimethoxyphenyl)-4-oxobut-2-enoic acid | CAS Registry Number: 80937-23-1
Synonyms: EINECS 279-631-0, BRN 3137849, 4-(3,4-Dimethoxyphenyl)-4-oxocrotonic acid, LS-47127, (E)-4-(3,4-Dimethoxyphenyl)-4-oxo-2-butenoic acid, 3-10-00-04602 (Beilstein Handbook Reference), 2-Butenoic acid, 4-(3,4-dimethoxyphenyl)-4-oxo-, (E)-, Acide (E)4-(3,4-dimethoxy-phenyl)-4-oxo-2-butenoique [French]

Molecular Formula: C12H12O5Molecular Weight: 236.220680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: QUWWWXPLUJFEHM-GQCTYLIASA-N

• 1,4-Dimethoxy-2-fluorobenzene
IUPAC Name: 2-fluoro-1,4-dimethoxybenzene | CAS Registry Number: 82830-49-7
Synonyms: 2,5-Dimethoxyfluorobenzene, ZINC02584336

Molecular Formula: C8H9FO2Molecular Weight: 156.154263 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WNCYZVMZKSOPMU-UHFFFAOYSA-N

• (R)-N-boc-3-Amino-Pyrrolidine
IUPAC Name: tert-butyl (3R)-3-aminopyrrolidine-1-carboxylate | CAS Registry Number: 147081-49-0
Synonyms: (R)-(+)-1-Boc-3-aminopyrrolidine, (r)-1-boc-3-aminopyrrolidine, (R)-3-Amino-1-N-BOC-pyrrolidine, r-bocap, (R)-(+)-N-Boc-3-aminopyrrolidine, (r)-tert-butyl 3-aminopyrrolidine-1-carboxylate, (R)-3-Amino-N-Boc-pyrrolidine, (R)-3-Amino-1-Boc-pyrrolidine, tert-butyl (3R)-3-aminopyrrolidine-1-carboxylate, (3r)-3-amino-1-(tert-butoxycarbonyl)pyrrolidine, (R)-1-N-Boc-3-Aminopyrrolidine, SBB028394, (r)-(+)-1-tboc-3-aminopyrrolidine, (3R)-(+)-1-(tert-Butoxycarbonyl)-3-aminopyrrolidine, AG-D-91849, (3R)-(+)-1-Boc-3-aminopyrrolidine, (r)-n-tert-butoxycarbonyl-3-aminopyrrolidine, (r)-3-amino-1-tert-butoxycarbonylpyrrolidine, (r)-3-amino-pyrrolidine-1-carboxylic acid tert-butyl ester, 1-Pyrrolidinecarboxylic acid, 3-amino-, 1,1-dimethylethyl ester, (3R)-

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

InChIKey: CMIBWIAICVBURI-SSDOTTSWSA-N

• 1,3,5-Trifluoro Benzene
IUPAC Name: 1,3,5-trifluorobenzene | CAS Registry Number: 372-38-3
Synonyms: sym-Trifluorobenzene, 1,3,5-TRIFLUOROBENZENE, Benzene, 1,3,5-trifluoro-, 1,3,5-Trifluoro-benzene, 196851_ALDRICH, CID9745, 1,3,5-TRIFLUORO BENZENE, JRD-0247, NSC10264, EINECS 206-751-2, ZINC00164868, SB 01896, TL8002744, 3S210982

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

InChIKey: JXUKFFRPLNTYIV-UHFFFAOYSA-N

• 1-(3-Bromo-4-Methoxyphenyl)ethanone
IUPAC Name: 1-(3-bromo-4-methoxyphenyl)ethanone | CAS Registry Number: 35310-75-9
Synonyms: 3'-Bromo-4'-methoxyacetophenone, ZINC00105308, 1-(3-Bromo-4-methoxyphenyl)ethanone, CID611661, STK058758, A3002/0126442

Molecular Formula: C9H9BrO2Molecular Weight: 229.070560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JYPGOBDETCKKKV-UHFFFAOYSA-N

• 1,1,3,3,5,5-Hexamethyltrisiloxane
IUPAC Name: [(dimethyl-$l^{3}-silanyl)oxy-dimethylsilyl]oxy-dimethylsilicon | CAS Registry Number: 1189-93-1
Synonyms: EINECS 214-716-8, 1,3,3,5,5-Hexamethyltrisiloxane, Trisiloxane, 1,1,3,3,5,5-hexamethyl-, CID6327152

Molecular Formula: C6H18O2Si3Molecular Weight: 206.462420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YTEISYFNYGDBRV-UHFFFAOYSA-N

• 1,4-Divinyloctafluorobutane
IUPAC Name: 3,3,4,4,5,5,6,6-octafluoroocta-1,7-diene | CAS Registry Number: 678-65-9
Synonyms: EINECS 211-650-1, CID69620, 3,3,4,4,5,5,6,6-Octafluoroocta-1,7-diene

Molecular Formula: C8H6F8Molecular Weight: 254.120466 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: XRSMAKAYKVRPSA-UHFFFAOYSA-N

• 1,8-Divinylperfluorooctane
IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluorododeca-1,11-diene | CAS Registry Number: 35192-44-0
Synonyms: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluorododeca-1,11-diene, PubChem21051, AC1MC6UK, CTK4H3862, MolPort-000-155-047, PC0820, FT-0607053, A822637, 1H,1H,2H,11H,12H,12H-Perfluorododeca-1,11-diene, 1,11-Dodecadiene,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluoro-, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecakis(fluoranyl)dodeca-1,11-diene

Molecular Formula: C12H6F16Molecular Weight: 454.150491 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 16

InChIKey: JJLUWYULIBMDGF-UHFFFAOYSA-N

• (S)-3-Hydroxy-1-benzylpyrrolidine
IUPAC Name: (3S)-1-benzylpyrrolidin-3-ol | CAS Registry Number: 101385-90-4
Synonyms: (S)-1-Benzyl-3-pyrrolidinol, (S)-1-Benzylpyrrolidin-3-ol, (S)-1-Benzyl-3-hydroxypyrrolidine, (3S)-1-benzylpyrrolidin-3-ol, s-bhp, (S)-(-)-1-Benzyl-3-pyrrolidinol, (s)-1-benzyl-pyrrolidin-3-ol, (S)-N-Benzyl-3-hydroxypyrrolidine, (s)-1-n-benzyl-3-hydroxypyrrolidine, (s)-n-benzyl-3-pyrrolidinol, (s)-1-benzyl-pyrrolidine-3-ol, (s)-3-hydroxy-1-benzylpyrrolidine, (3s)-(-)-n-benzyl-3-pyrrolidinol, (S)-3-Hydroxy-1-benzyl-pyrrolidine, (s)-1-n-benzyl-3-hydroxypyrrolidinol, (s)-(-)-1-benzyl-3-hydroxypyrrolidine, (s)-(-)-n-benzyl 3-hydroxypyrrolidine, ST50408489, (S)-( pound inverted question mark)-1-Benzyl-3-pyrrolidinol, PubChem13097

Molecular Formula: C11H15NOMolecular Weight: 177.242900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YQMXOIAIYXXXEE-NSHDSACASA-N

• (R)-(-)-2-(tertButoxycarbonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
IUPAC Name: (3R)-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate | CAS Registry Number: 115962-35-1
Synonyms: ZINC00057554, ZINC04208809, CID7129828

Molecular Formula: C15H18NO4-Molecular Weight: 276.307720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HFPVZPNLMJDJFB-GFCCVEGCSA-M

• (4R,6R)-t-Butyl-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetate
IUPAC Name: 2-[(4R,6R)-2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,3-dioxan-4-yl]ethylazanium | CAS Registry Number: 125995-13-3
Synonyms: ZINC04284042, CID7168028

Molecular Formula: C14H28NO4+Molecular Weight: 274.376420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HWSHVKNLMBMKSR-GHMZBOCLSA-O

• (1S,2R)-(-)-1Amino-2-indanol
IUPAC Name: [(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]azanium | CAS Registry Number: 126456-43-7
Synonyms: ZINC00154811, ZINC00154815, CID10942615

Molecular Formula: C9H12NO+Molecular Weight: 150.197680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: LOPKSXMQWBYUOI-BDAKNGLRSA-O

• 1-(Chloro-1-pyrrolidinylmethylene)pyrrolidiniumhexafluorophosphate
IUPAC Name: 1-[chloro(pyrrolidin-1-ium-1-ylidene)methyl]pyrrolidine;hexafluorophosphate | CAS Registry Number: 135540-11-3
Synonyms: PyClU, 1-(Chloro-1-pyrrolidinylmethylene)pyrrolidinium Hexafluorophosphate, Chlorodipyrrolidinocarbenium hexafluorophosphate, PYCIU, Chlorodipyrrolidinocarbenium hexafluorophosphate, Chloro-N,N,N',N'-bis(tetramethylene)formamidinium hexafluorophosphate, N,N,N',N'-Bis(tetramethylene)chloroformamidinium hexafluorophosphate, ACMC-209c3q, 23955_ALDRICH, AC1MC626, 23955_FLUKA, MolPort-001-771-211, ANW-19956, AKOS015901338, AM83857, RL01597, AK-41346, KB-48860, AB1011418, ST51054067, A15206

Molecular Formula: C9H16ClF6N2PMolecular Weight: 332.653921 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: NHEGCUSBUWGOQM-UHFFFAOYSA-N

• 1,2-Dichloro-3,3,3-trifluoro-2-(trifluoromethyl)propane
IUPAC Name: 2-chloro-2-(chloromethyl)-1,1,1,3,3,3-hexafluoropropane | CAS Registry Number: 138690-25-2
Synonyms: 2-chloro-2-(chloromethyl)-1,1,1,3,3,3-hexafluoropropane, Propane,2-chloro-2-(chloromethyl)-1,1,1,3,3,3-hexafluoro-, AC1MCNUA, Dichlorohexafluoroisobutane, ACMC-1BX6G, CTK4C1360, MolPort-001-777-753, ANW-55700, PC8346, SBB098337, AKOS015850576, AG-D-78178, AK-58908, KB-149193, FT-0606377, A807419, I14-28745, 2,3-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)propane, 2-chloranyl-2-(chloromethyl)-1,1,1,3,3,3-hexakis(fluoranyl)propane, DICHLOROHEXAFLUOROISOBUTANE;1,2-DICHLORO-3,3,3-TRIFLUORO-2-(TRIFLUOROMETHYL)PROPANE;1,2-Dichloro-3,3,3-trifluoro-2-(trifluoromethyl)propane 97%;1,2-Dichloro-3,3,3-trifluoro-2-(trifluoromethyl)propane97%

Molecular Formula: C4H2Cl2F6Molecular Weight: 234.955099 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: BDDXNQXIECRUSQ-UHFFFAOYSA-N

• 1,4-Difluoro-2-methyl-5-nitrobenzene
IUPAC Name: 1,4-difluoro-2-methyl-5-nitrobenzene | CAS Registry Number: 141412-60-4
Synonyms: NSC25759, ZINC01628021, 1,4-difluoro-2-methyl-5-nitrobenzene, 10R-0045

Molecular Formula: C7H5F2NO2Molecular Weight: 173.116906 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ABWWQMGGJXKGBL-UHFFFAOYSA-N


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