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Profile: Chempure is involved in the business of chemicals. We provide bio-chemical, fine, organic and specialty research chemicals. Our products include abietic acid, 2-cis-4-trans-abscisic acid, 2-acetamido-5-aminopyridine, 2-amino-4-chloro-6-methylpyrimidine, barium acetate, barium bromate, cadmium carbonate, cadmium sulfate octahydrate, 3-decanone, 2,5-difluorotoluene, 3,4-(ethylenedioxy)benzeneboronic acid and 3-ethyl-3-hexanol.

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• 1-Chloroanthraquinone
IUPAC Name: 1-chloroanthracene-9,10-dione | CAS Registry Number: 82-44-0
Synonyms: Anthraquinone, 1-chloro-, Chloroanthraquinone, 1-CHLOROANTHRAQUINONE, alpha-Chloroanthraquinone, 1-Chloro-9,10-anthraquinone, 9,10-Anthracenedione, 1-chloro-, alpha-Monochloroanthraquinone, 1-Chloranthrachinon [Czech], .alpha.-Chloroanthraquinone, C23209_ALDRICH, Chloro-9,10-anthracenedione, HSDB 2565, .alpha.-Monochloroanthraquinone, 1-Chloroanthra-9,10-quinone, 9,10-Anthracenedione, chloro-, EINECS 201-421-4, NSC5138, NSC 30428, AIDS001366, WLN: L C666 BV IVJ DG

Molecular Formula: C14H7ClO2Molecular Weight: 242.657180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BOCJQSFSGAZAPQ-UHFFFAOYSA-N

• 1-Phenylurazole
IUPAC Name: 1-phenyl-1,2,4-triazolidine-3,5-dione | CAS Registry Number: 6942-46-7
Synonyms: Bicarbamimide, 2-phenyl-, NSC57497, AIDS020337, AIDS-020337, CID95671, NSC28780, ZINC06116837, 1,2-Hydrazinedicarboxamide, 1-phenyl-, 1-Phenyl-1,2,4-triazolidine-3,5-dione, 1,2,4-Triazolidine-3,5-dione, 1-phenyl-, LT00453725

Molecular Formula: C8H7N3O2Molecular Weight: 177.160080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WFYLHMAYBQLBEM-UHFFFAOYSA-N

• 1-chloro-2-dimethyl-3-Phenyl propane
IUPAC Name: (1-chloro-2-methylpropan-2-yl)benzene | CAS Registry Number: 515-40-2
Synonyms: Neophyl chloride, beta-Chloro-tert-butylbenzene, 1-Chloro-2-methyl-2-phenylpropane, 2-Methyl-2-phenylpropyl chloride, 2-Chloromethyl-2-phenylpropane, (2-Chloro-1,1-dimethylethyl)benzene, 246506_ALDRICH, NSC923, (beta-Chloro-tert-butyl)benzene, .beta.-Chloro-tert-butylbenzene, (.beta.-Chloro-tert-butyl)benzene, Benzene, (2-chloro-1,1-dimethylethyl)-, beta,beta-Dimethylphenethyl chloride, NSC54159, EINECS 208-197-7, NSC 54159, .beta.,.beta.-Dimethylphenethyl chloride, (beta-Chloro-alpha,alpha-dimethyl)ethylbenzene, (.beta.-Chloro-.alpha.,.alpha.-dimethyl)ethylbenzene

Molecular Formula: C10H13ClMolecular Weight: 168.663220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DNXXUUPUQXSUFH-UHFFFAOYSA-N

• 2-Naphthaleneethanol
IUPAC Name: 1-naphthalen-2-ylethanol | CAS Registry Number: 7228-47-9
Synonyms: 1-(2-Naphthyl)ethanol, Maybridge4_000495, 1-naphthalen-2-yl-ethanol, beta-Naphthyl methyl carbinol, 192996_ALDRICH, NSC92277, .alpha.-Methyl-2-naphthalenemethanol, AKE-BBV-142544, alpha-Methyl-2-naphthalenemethanol, alpha-Methylnaphthalene-2-methanol, CID98243, EINECS 230-630-3, BBV-142544, IDI1_031077, NCGC00177518-01, 2-Naphthalenemethanol, .alpha.-methyl-, ( )-, 2-Naphthalenemethanol, .alpha.-methyl-, (.+/-.)-, 2-Naphthalenemethanol, .alpha.-methyl-, (.+-.)-, BRD-A66746621-001-01-3

Molecular Formula: C12H12OMolecular Weight: 172.223080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: AXRKCRWZRKETCK-UHFFFAOYSA-N

• 19-Iodocholesterol
IUPAC Name: (3S,8S,9S,10S,13R,14S,17R)-10-(iodanylmethyl)-13-methyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 37414-03-2
Synonyms: Iodocholesterol I 131, 19-Iodocholest-5-en-3beta-ol, EINECS 253-499-4, CID3032874, Cholest-5-en-3-ol, 19-iodo-, (3beta)-, Cholest-5-en-3-ol, 19-(iodo-125I)-, (3beta)-, 30461-91-7

Molecular Formula: C27H45IOMolecular Weight: 510.550224 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: FIOAEFCJGZJUPW-HEDRMPLKSA-N

• 1-Hydroxycyclohexyl phenyl ketone
IUPAC Name: (1-hydroxycyclohexyl)-phenylmethanone | CAS Registry Number: 947-19-3
Synonyms: Hydroxycyclohexyl phenyl ketone, 405612_ALDRICH, Methanone, (1-hydroxycyclohexyl)phenyl-, CID70355, EINECS 213-426-9, NSC401908, ZINC00155086, (1-Hydroxycyclohexyl)(phenyl)methanone, NSC 401908, ST5319491, TL8005970, 127546-04-7, 150080-97-0, 97396-91-3

Molecular Formula: C13H16O2Molecular Weight: 204.264940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QNODIIQQMGDSEF-UHFFFAOYSA-N

• (-)-Cotinine
IUPAC Name: 1-methyl-5-pyridin-3-ylpyrrolidin-2-one | CAS Registry Number: 486-56-6
Synonyms: cotinine, Scotine, (S)-Cotinine, Cotinine [INN], (S)-(-)-Cotinine, Cotininum [INN-Latin], Cotinina [INN-Spanish], CCRIS 7625, C10H12N2O, EINECS 207-634-9, NIH 10498, BRN 0083099, 2-Pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, (S)-, NCGC00093739-01, NCGC00093739-02, NCGC00093739-03, NCGC00093739-04, NCGC00093739-05, NCGC00093739-06, NCGC00093739-07

Molecular Formula: C10H12N2OMolecular Weight: 176.215080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UIKROCXWUNQSPJ-UHFFFAOYSA-N

• (4s)-(-)-4-Isopropyl-1,3-Oxazolidine-2-Thione, 98
IUPAC Name: (4S)-4-propan-2-yl-1,3-oxazolidine-2-thione | CAS Registry Number: 84272-19-5
Synonyms: 345407_ALDRICH, ZINC04531699, CID7271926, (S)-(-)-4-Isopropyl-2-oxazolidinethione, InChI=1/C6H11NOS/c1-4(2)5-3-8-6(9)7-5/h4-5H,3H2,1-2H3,(H,7,9

Molecular Formula: C6H11NOSMolecular Weight: 145.222640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: CIRDXQWBLPPFPN-RXMQYKEDSA-N

• 2,2'-Ethylenebis(1,3-Dithiane)
IUPAC Name: 2-[2-(1,3-dithian-2-yl)ethyl]-1,3-dithiane | CAS Registry Number: 14947-53-6
Synonyms: NSC280436, CID84720, 2,2'-(Ethylene)di-1,3-dithiane, EINECS 239-022-2, ZINC00157036, LT00847977

Molecular Formula: C10H18S4Molecular Weight: 266.509920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: RVIPSMFHRZBJRI-UHFFFAOYSA-N

• 2,2-Bis(4-Carboxyphenyl)Hexafluoropropane
IUPAC Name: 4-[2-(4-carboxyphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid | CAS Registry Number: 1171-47-7
Synonyms: 367672_ALDRICH, CID633763, 2,2-Bis[4-carboxyphenyl]hexafluoropropane, 2,2-Bis(4-carboxyphenyl)hexafluoropropane, LT00160097, 4,4'-(Hexafluoroisopropylidene)bis(benzoic acid), Benzoic acid, 4,4'-(2,2,2-trifluoro-1-(trifluoromethyl)ethylidene)bis-, 936941-90-1

Molecular Formula: C17H10F6O4Molecular Weight: 392.249319 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: PHQYMDAUTAXXFZ-UHFFFAOYSA-N

• 1-Amino-2-Naphthol-4-Sulphonic Acid
IUPAC Name: 4-amino-3-hydroxynaphthalene-1-sulfonic acid | CAS Registry Number: 116-63-2
Synonyms: Ambap129, 1-Amino-4-sulfo-2-naphthol, 1,2,4-Acid, 1-Amino-2-naphthol-4-sulfonic acid, 4-Amino-3-hydroxy-1-naphthalenesulfonic acid, 109754_ALDRICH, 2-Hydroxy-4-sulfo-1-naphthylamine, 08751_FLUKA, CHEBI:19024, EINECS 204-147-3, NSC4986, NSC 25061, AIDS001789, 398969_SIAL, AIDS-001789, NSC25061, SBB008870, 4-Amino-3-hydroxynaphthalenesulfonic acid, 4-NH2-3-OH-naphthalenesulfonic acid, 4-Amino-3-hydroxynaphthalene-1-sulphonic acid

Molecular Formula: C10H9NO4SMolecular Weight: 239.247760 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: RXCMFQDTWCCLBL-UHFFFAOYSA-N

• 1-(4-Methoxyphenyl)Imidazoline-2-Thione
IUPAC Name: 3-(4-methoxyphenyl)-1H-imidazole-2-thione | CAS Registry Number: 17452-14-1
Synonyms: CHEBI:231442, 1-(4-Methoxyphenyl)imidazoline-2-thione, ZINC00156317, ZINC03356995, CID2759656, LT00454502, 1-(4-Methoxyphenyl)-1,3-dihydro-2H-imidazole-2-thione, T5384465, 1-(4-Methoxy-phenyl)-1,3-dihydro-imidazole-2-thione

Molecular Formula: C10H10N2OSMolecular Weight: 206.264200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LIEBCNQPMNARMP-UHFFFAOYSA-N

• 1-Bromo-2,3,5-Trichlorobenzene
IUPAC Name: 1-bromo-2,3,5-trichlorobenzene | CAS Registry Number: 81067-38-1
Synonyms: 1-Bromo-2,3,5-trichlorobenzene, 2,3,5-Trichlorobromobenzene, AG-H-25815, ST50408630, PubChem3192, ACMC-209pkn, AC1N9BEH, SureCN6500390, CTK5E8439, WOIGJFAVHOCDDW-UHFFFAOYSA-, MolPort-003-922-628, 1-Bromo-2,3,5-trichlorobenzene,, 1-Bromo-2,3,5-trichlorobenzene;, ANW-37413, Benzene,1-bromo-2,3,5-trichloro-, ZINC00402224, AKOS015834871, MCULE-4461466529, 1-bromanyl-2,3,5-tris(chloranyl)benzene, AK115319

Molecular Formula: C6H2BrCl3Molecular Weight: 260.343080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WOIGJFAVHOCDDW-UHFFFAOYSA-N

• 1-(Benzylthio)-2-propanone
IUPAC Name: 1-(phenylmethylsulfanyl)propan-2-one | CAS Registry Number: 10230-69-0
Synonyms: 1-(Benzylthio)acetone, alpha-(Benzylthio)acetone, .alpha.-(Benzylthio)acetone, EINECS 233-552-8, ZINC02165911, ST5407883

Molecular Formula: C10H12OSMolecular Weight: 180.266680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: OIEDQMIEPJIRFT-UHFFFAOYSA-N

• 10,11-Dihydrocarbamazepine
IUPAC Name: 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide | CAS Registry Number: 3564-73-6
Synonyms: Oprea1_404143, 195421_ALDRICH, EINECS 222-649-0, BRN 0196969, ZINC03008650, GP 26-301, LS-60363, ST044503, EU-0076522, 10,11-Dihydro-5H-dibenz(b,f)azepine-5-carboxamide, 4-20-00-03905 (Beilstein Handbook Reference), 10,11-Dihydro-5H-dibenz[b,f]azepine-5-carboxamide, 5H-DIBENZ(b,f)AZEPINE-5-CARBOXAMIDE, 10,11-DIHYDRO-, 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-

Molecular Formula: C15H14N2OMolecular Weight: 238.284460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: PHNLCHMJDSSPDQ-UHFFFAOYSA-N

• (Chloromethyl)Triphenylphosphonium Iodide
IUPAC Name: chloromethyl(triphenyl)phosphanium;iodide | CAS Registry Number: 68089-86-1
Synonyms: (CHLOROMETHYL)TRIPHENYLPHOSPHONIUM IODIDE, AG-G-59700, AGN-PC-009F36, CTK5C7291, ANW-42316, AKOS016010467, AK117236, KB-209159, FT-0604889, Phosphonium, (chloromethyl)triphenyl-, iodide

Molecular Formula: C19H17ClIPMolecular Weight: 438.669512 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YMNRWRKDEPEIAQ-UHFFFAOYSA-M

• 1-Piperidine Ethanol
IUPAC Name: 2-piperidin-1-ylethanol | CAS Registry Number: 3040-44-6
Synonyms: 2-Piperidinoethanol, 1-PIPERIDINEETHANOL, N-Piperidineethanol, beta-Piperidylethanol, beta-Piperidinoethanol, .beta.-Piperidinoethanol, N-(Hydroxyethyl)piperidine, 2-(1-Piperidinyl)ethanol, 1-(2-Hydroxyethyl)piperidine, .beta.-Piperidylethanol, 2-PIPERIDINEETHANOL, N-(2-Hydroxyethyl)piperidine, 116068_ALDRICH, 1-Oxa-4-azaspiro[3.5]nonane, NSC 3460, EINECS 221-244-6, NSC3460, 1-Oxa-4-azaspiro(3.5)nonane (VAN), BRN 0103390, AI3-11737

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

InChIKey: KZTWONRVIPPDKH-UHFFFAOYSA-N

• 1,2,3,4-Tetrahydrocarbazole
IUPAC Name: 2,3,4,9-tetrahydro-1H-carbazole | CAS Registry Number: 942-01-8
Synonyms: 2,3-Tetramethyleneindole, 5,6,7,8-Tetrahydrocarbazole, 2,3-Tetramethylene-1H-indole, 2,3,4,9-Tetrahydro-1H-carbazole, Carbazole, 1,2,3,4-tetrahydro-, 1H-Carbazole, 2,3,4,9-tetrahydro-, T12408_ALDRICH, EINECS 213-385-7, 1H-Indole, 2,3-(1,4-butanediyl)-, NSC 17329, WLN: T B656 HM&&TJ, CARBAZOLE, 5,6,7,8-TETRAHYDRO-, NSC17329, 5,6,7,8-Tetrahydro-9H-carbazole, BRN 0133771, ZINC00967256, CARBAZOLE,1,2,3,4-TETRAHYDRO, LS-51830, Carbazole, 1,2,3,4-tetrahydro- (8CI), TL8005952

Molecular Formula: C12H13NMolecular Weight: 171.238320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XKLNOVWDVMWTOB-UHFFFAOYSA-N

• 1,4-Benzenediboronic acid bis(neophtyl glycol) ester
IUPAC Name: 2-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]-5,5-dimethyl-1,3,2-dioxaborinane | CAS Registry Number: 5565-36-6
Synonyms: SureCN4264297, CTK8F2997, AKOS004115036, AG-F-94774, MCULE-7601774149, KB-10498, FT-0606764, ST50408241, 1,4-Benzenediboronic acid bis(neopentyl glycol) ester, 1,4-Benzenediboronic acid bisneopentylglycol cyclic ester, I14-106738, p-Benzenediboronicacid, cyclic bis(2,2-dimethyltrimethylene) ester (6CI,7CI,8CI)

Molecular Formula: C16H24B2O4Molecular Weight: 301.981360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XDODHEZHZCJSML-UHFFFAOYSA-N

• 1-Iodo-2,2,3,3,3-Pentafluoropropane
IUPAC Name: 1,1,1,2,2-pentafluoro-3-iodopropane | CAS Registry Number: 354-69-8
Synonyms: Pentafluoropropyl iodide, 1H,1H-Pentafluoropropyl iodide, 2,2,3,3,3-Pentafluoropropyl iodide, CID67721, EINECS 206-568-8, NSC141151, NSC 141151, 1,1,1,2,2-Pentafluoro-3-iodopropane, Propane, 1,1,1,2,2-pentafluoro-3-iodo-

Molecular Formula: C3H2F5IMolecular Weight: 259.944466 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: HENALDZJQYAUBN-UHFFFAOYSA-N

• 1-Bromo-3-Isopropoxybenzene
IUPAC Name: 1-bromo-3-propan-2-yloxybenzene | CAS Registry Number: 131738-73-3
Synonyms: 1-Bromo-3-isopropoxybenzene, 3-Bromophenyl isopropyl ether, 3-bromo-isopropoxybenzene, 3-bromoisoproproxylbenzene, 2-(3-Bromophenoxy)propane, 1-bromo-3-propan-2-yloxybenzene, 1-bromo-3-(propan-2-yloxy)benzene, ST50408776, ZINC00403355, PubChem14867, 3-bromoisopropoxybenzene, AC1MMGU8, AC1Q1QN1, SureCN1204347, SureCN8384042, 3-Isopropoxy-1-bromobenzene, ACMC-1C80U, 3-bromo phenyl isopropyl ether, 3-Bromophenyl Isopropyl Ketone, Isopropyl 3-Bromophenyl Ketone

Molecular Formula: C9H11BrOMolecular Weight: 215.087040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JYWJZIQSPRFCDB-UHFFFAOYSA-N

• (S)-5,5-Diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine
IUPAC Name: (3aS)-1-methyl-3,3-diphenyl-3a,4,5,6-tetrahydropyrrolo[1,2-c][1,3,2]oxazaborole | CAS Registry Number: 112022-81-8
Synonyms: (S)-2-Methyl-CBS-oxazaborolidine, Corey catalyst, (S)-Me-CBS Catalyst, (S)-ME CBS, (S)-(-)-2-Methyl-CBS-oxazaborolidine, (S)-Methyl-CBS-oxazaborolidine, Corey's catalyst, (S)-1-Methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2c][1,3,2]oxazaborole, (S)-3,3-Diphenyl-1-methyltetrahydro-1H,3H-pyrrolo[1,2-c][1,3,2]oxazaborole, (S)-3,3-Diphenyl-1-methyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole, (S)-Tetrahydro-1-methyl-3,3-diphenyl-1H,3H-pyrrolo[1,2-c][1,3,2]oxazaborole, (S)-3,3-Diphenyl-1-methylpyrrolidino[1,2-c]-1,3,2-oxazaborole, (S)-(-)-2-Methyl-CBS-oxazaborolidine solution, alpha,alpha-Diphenyl-L-prolinol methylboronic acid cycl-amide ester, PubChem14261, AC1MC1RE, (S)-METHYL-CBS, (S)-CBS CATALYST, SureCN263582, KSC498C4D

Molecular Formula: C18H20BNOMolecular Weight: 277.168500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VMKAFJQFKBASMU-KRWDZBQOSA-N

• 1-(2-Pyridylazo)-2-naphthol
IUPAC Name: 1-(pyridin-2-ylhydrazinylidene)naphthalen-2-one | CAS Registry Number: 85-85-8
Synonyms: PAN (indicator), NSC5332, 2-Naphthol, 1-(2-pyridylazo)-, ZINC03860832, 1-(2-Pyridylazo)-2-hydroxynaphthalene, 2-Hydroxy-1-(2-pyridylazo)naphthalene, 2-Naphthalenol, 1-(2-pyridinylazo)-, Pan

Molecular Formula: C15H11N3OMolecular Weight: 249.267340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RAXUMGMWXZYADR-UHFFFAOYSA-N

• (R)-2-Chloro-1-Phenylethanol
IUPAC Name: 2-chloro-1-phenylethanol | CAS Registry Number: 56751-12-3
Synonyms: Styrene chlorohydrin, 2-Chloro-1-phenylethanol, CID92898, EINECS 216-816-7, ZINC02555239, (R)-(-)-2-Chloro-1-phenylethanol, (S)-(+)-2-Chloro-1-phenylethanol, Benzenemethanol, alpha-(chloromethyl)-, Benzyl alcohol, .alpha.-(chloromethyl)-, Benzenemethanol, .alpha.-(chloromethyl)-, LT03383038, 1674-30-2, 70111-05-6

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

InChIKey: XWCQSILTDPAWDP-UHFFFAOYSA-N

• 2-Iodo-1,3-Dimethylbenzene
IUPAC Name: 2-iodo-1,3-dimethylbenzene | CAS Registry Number: 608-28-6
Synonyms: 2-Iodo-m-xylene, m-Xylene, 2-iodo-, 2,6-Dimethyliodobenzene, Benzene, 2-iodo-1,3-dimethyl-, 2-Iodo-1,3-dimethylbenzene, NSC9265, m-Xylene, 2-iodo- (8CI), 596795_ALDRICH, CID69097, NSC 9265, DP01104

Molecular Formula: C8H9IMolecular Weight: 232.061530 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QTUGGVBKWIYQSS-UHFFFAOYSA-N

• 1-Isopropyl-3-(4-fluorophenyl)indole
IUPAC Name: 3-(4-fluorophenyl)-1-propan-2-ylindole | CAS Registry Number: 93957-49-4
Synonyms: 3-(4-fluorophenyl)-1-isopropyl-1h-indole, 1-ISOPROPYL-3-(4-FLUOROPHENYL)INDOLE, 3-(4-Fluorophenyl)-1-isopropylindole, AG-H-85440, 1-Isopropyl-3-(4-flrorophenyl)-indole, 3-(4-fluorophenyl)-1-propan-2-ylindole, ST50408249, 3-(4-fluorophenyl)-1-(methylethyl)indole, 3-(4-fluorophenyl)-1-propan-2-yl-indole, ZINC00156443, PubChem7300, AC1LEHNF, ACMC-209rob, AC1Q4OIC, SureCN1878132, CTK5H4173, MolPort-001-775-669, ACN-S003329, ANW-40137, AR-1E6936

Molecular Formula: C17H16FNMolecular Weight: 253.314043 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZDZJOIIBECYKAJ-UHFFFAOYSA-N

• 1-Ethyl-(3 Dimethylamino)Propyl Carbodiamide
IUPAC Name: 3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine hydrochloride | CAS Registry Number: 25952-53-8
Synonyms: EDCI, EDAC, Hydrochloride, EDAP, WLN: 2NCN3N1&1 &GH, NSC97064, [3-(Dimethylamino)propyl]ethyl carbodiimide hydrochloride, 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride, 1-Ethyl-3-(3′-dimethylaminopropyl)carbodiimide, HCl, 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide hydrochloride, N-ETHYL-N'(3-DIMETHYLAMINOPROPYL) CARBODIIMIDE HCl, 1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide hydrochloride, 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide monohydrochloride, 1-Ethyl-3-[(3-(dimethylamino)propyl]carbodiimide hydrochloride, 1-Ethyl-3-[3'-(dimethylamino)propyl]carbodiimide hydrochloride, Carbodiimide, [3-(dimethylamino)propyl]ethyl-, hydrochloride, N-[3-(Dimethylamino)propyl]-N'-ethylcarbodiimide hydrochloride, N-Ethyl-N'-(3-dimethylaminopropyl)carbodiimide hydrochloride, N-Ethyl-N'-[3-(dimethylamino)propyl]carbodiimide hydrochloride, 1-Ethyl-3-[3-(dimethylamino)propyl]carbodiimide monohydrochloride, CARBODIIMIDE, (3-DIMETHYLAMINOPROPYL)ETHYL-, HYDROCHLORIDE

Molecular Formula: C8H18ClN3Molecular Weight: 191.701620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FPQQSJJWHUJYPU-UHFFFAOYSA-N

• 1,2-Epoxy-9-Decene
IUPAC Name: 2-oct-7-enyloxirane | CAS Registry Number: 85721-25-1
Synonyms: Oct-7-enyloxirane, (7-Octenyl)oxirane, 2-(7-Octenyl)oxirane, 1,2-Epoxy-9-decene, Oxirane, (7-octenyl)-, 410829_ALDRICH, EINECS 288-437-5, CID543758, ZINC02569686

Molecular Formula: C10H18OMolecular Weight: 154.249320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FCZHJHKCOZGQJZ-UHFFFAOYSA-N

• 1-Chloro-4-Phenylbutane
IUPAC Name: 4-chlorobutylbenzene | CAS Registry Number: 4830-93-7
Synonyms: 4-Phenylbutyl chloride, (4-Chlorobutyl)benzene, 1-Chloro-4-phenylbutane, Benzene, (4-chlorobutyl)-, 461776_ALDRICH, CID78543, EINECS 225-408-8, BBV-5725998

Molecular Formula: C10H13ClMolecular Weight: 168.663220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FLLZCZIHURYEQP-UHFFFAOYSA-N

• ( R )-5,5-Diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborlidine
IUPAC Name: (3aR)-1-methyl-3,3-diphenyl-3a,4,5,6-tetrahydropyrrolo[1,2-c][1,3,2]oxazaborole | CAS Registry Number: 112022-83-0
Synonyms: (R)-2-Methyl-CBS-oxazaborolidine, (R)-METHYL OXAZABOROLIDINE, (R)-5,5-Diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine, (R)-Me-CBS Catalyst, (R)-ME CBS, (R)-(+)-2-Methyl-CBS-oxazaborolidine, Corey's catalyst, (R)-3,3-Diphenyl-1-methyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole, (R)-Tetrahydro-1-methyl-3,3-diphenyl-1H,3H-pyrrolo[1,2-c][1,3,2]oxazaborole, (R)-3,3-Diphenyl-1-methylpyrrolidino[1,2-c]-1,3,2-oxazaborole, (R)-1-Methyl,3,3-diphenyl-tetrahydro-pyrrolo(1,2-c)(1,3,2)oxazaborole, (R)-(+)-2-Methyl-CBS-oxazaborolidine solution, alpha,alpha-Diphenyl-D-prolinolmethylboronic acid cyclamide ester, (R)-3,3-Diphenyl-1-methyltetrahydro-1H,3H-pyrrolo[1,2-c][1,3,2]oxazaborole, alpha,alpha-Diphenyl-D-prolinol methylboronic acid cycl-amide-ester, (R)-Methyl oxazaborolidine 1M in toluene, 69597-55-3, PubChem9360, PubChem14258, (R)-METHYL-CBS

Molecular Formula: C18H20BNOMolecular Weight: 277.168500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VMKAFJQFKBASMU-QGZVFWFLSA-N

• 1-N-Hexyltheobromine
IUPAC Name: 1-hexyl-3,7-dimethylpurine-2,6-dione | CAS Registry Number: 1028-33-7
Synonyms: Pentifylline, Pentifyllin, Cosaldon, Cosadon, Hexyltheobromine, 1-Hexyltheobromine, Pentifyllinum, Pentifilina, Pentigetide, Tonostan, Cosaldon retard, Pentifylline (INN), Theobromine, 1-hexyl-, SK 7 (Pharmaceutical), Pentifilina [INN-Spanish], Pentifyllinum [INN-Latin], UNII-MBM1C4K26S, 1-Hexyl-3,7-dimethylxanthine, SK 7, Pentifylline [INN:BAN:DCF]

Molecular Formula: C13H20N4O2Molecular Weight: 264.323500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MRWQRJMESRRJJB-UHFFFAOYSA-N

• (R,R)-(+)-Hydrobenzoin
IUPAC Name: (1R,2R)-1,2-diphenylethane-1,2-diol | CAS Registry Number: 52340-78-0
Synonyms: (+)-hydrobenzoin, meso-Stilbene glycol, 256277_ALDRICH, 53945_FLUKA, CHEBI:50014, CPD-8985, (R,R)-1,2-Diphenylethylene glycol, CID853019, ZINC00388744, (R,R)-1,2-Diphenyl-1,2-ethanediol, (+)-(1R,2R)-1,2-Diphenylethane-1,2-diol, (1R,2R)-1,2-diphenylethane-1,2-diol, C16015

Molecular Formula: C14H14O2Molecular Weight: 214.259760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IHPDTPWNFBQHEB-ZIAGYGMSSA-N

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

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

InChIKey: MOYSMPXSEXYEJV-UHFFFAOYSA-M

• 10,12-docosadiyndioic Acid
IUPAC Name: docosa-10,12-diynedioic acid | CAS Registry Number: 28393-02-4
Synonyms: 10,12-Docosadiynedioic acid, docosa-10,12-diynedioic acid, ACMC-20aozt, AC1LBXFT, 10,12-Docosadiynedioicacid, 10,12-Docasadiyndioic acid, CTK0J9680, MolPort-004-947-244, SBB008740, AG-E-91078, 5817P, FT-0607182, ST50308716, I14-62964, Docosadeca-10,12-diynedioic acid;Docosa-10,12-diyndioicacid;docosa-10,12-diynedioic acid;

Molecular Formula: C22H34O4Molecular Weight: 362.502960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XCUAGNLOPZWTEH-UHFFFAOYSA-N

• (±)-2-Aminoheptane sulfate
IUPAC Name: heptan-2-ylazanium sulfate | CAS Registry Number: 6411-75-2
Synonyms: Tuamine sulfate, Tuaminoheptane sulfate, 2-Heptylamine sulfate, 2-Aminoheptane sulfate, 1-Methylhexylamine sulfate, 2-Aminoheptane sulfate (VAN), Hexylamine, 1-methyl-, sulfate, 2-Heptanamine, sulfate (2:1), C7H17N, EINECS 229-113-5, NSC 27117, Bis((1-methylhexyl)ammonium) sulphate, CID22921, LS-75730, HEXYLAMINE, 1-METHYL-, SULFATE (2:1), 123-82-0

Molecular Formula: C14H36N2O4SMolecular Weight: 328.511640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XKUUMWKWUZRRPD-UHFFFAOYSA-N

• 1,3-Dibromo-2,2-Diethylpropane
IUPAC Name: 3,3-bis(bromomethyl)pentane | CAS Registry Number: 67969-84-0
Synonyms: 1,3-Dibromo-2,2-diethylpropane, Pentane, 3,3-bis(bromomethyl)-, 3,3-Bis(bromomethyl)pentane, EINECS 267-985-9, CID106258, 2,2-DIETHYL-1,3-DIBROMOPROPANE

Molecular Formula: C7H14Br2Molecular Weight: 257.994060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ZIQNZEFIQWBNHV-UHFFFAOYSA-N

• 1-Chloro-8-Phenyloctane
IUPAC Name: 8-chlorooctylbenzene | CAS Registry Number: 61440-32-2
Synonyms: 1-Chloro-8-phenyloctane, 8-Phenyl-1-octyl chloride, Octane, 1-chloro-8-phenyl, NSC152904, CID290151

Molecular Formula: C14H21ClMolecular Weight: 224.769540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GVDYDOFBAKCSGC-UHFFFAOYSA-N

• (1-Heptyl)triphenylphosphonium bromide
IUPAC Name: heptyl(triphenyl)phosphanium bromide | CAS Registry Number: 13423-48-8
Synonyms: Heptyltriphenylphosphonium bromide, 377538_ALDRICH, EINECS 236-539-5, CID2724567, N-HEPTYL TRIPHENYL PHOSPHONIUMBROMIDE

Molecular Formula: C25H30BrPMolecular Weight: 441.383461 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WCZSOHSGMBVYFW-UHFFFAOYSA-M

• 1,4-Diphenylbutadiyne
IUPAC Name: 4-phenylbuta-1,3-diynylbenzene | CAS Registry Number: 886-66-8
Synonyms: Diphenylbutadiyne, Diphenyldiacetylene, Butadiyne, diphenyl-, Diphenyl-1,3-butadiyne, 1,4-Diphenyl-1,3-butadiyne, Butadiyne, diphenyl- (8CI), 161233_ALDRICH, CHEBI:51588, Benzene, 1,1'-(1,3-butadiyne-1,4-diyl)bis-, AIDS373720, (4-Phenyl-1,3-butadiynyl)benzene, 4-phenyl-buta-1,3-diynyl-benzene, AIDS-373720, CID70174, EINECS 212-953-1, NSC529170, SBB008711, 1,1'-buta-1,3-diyne-1,4-diyldibenzene, NSC 529170, 1,1'-(1,3-Butadiyne-1,4-diyl)bisbenzene

Molecular Formula: C16H10Molecular Weight: 202.250600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: HMQFJYLWNWIYKQ-UHFFFAOYSA-N

• (S)-(+)-Phenylsuccinic Acid
IUPAC Name: 2-phenylbutanedioic acid | CAS Registry Number: 4036-30-0
Synonyms: Phenylsuccinic acid, Phenylsuccinate, 2-Phenylsuccinate, 2-Phenylsuccinic acid, Succinic acid, phenyl-, Butanedioic acid, phenyl-, Phenyl-succinic acid, dl-Phenylsuccinic acid, 2-Phenyl-succinic acid, (S)-Phenylsuccinic acid, alpha-Phenylsuccinic acid, .alpha.-Phenylsuccinic acid, (+/-)-Phenylsuccinic acid, Butanedioic acid, 2-phenyl-, P35200_ALDRICH, Succinic acid, phenyl- (8CI), 78170_FLUKA, AKE-BBR-007409, (+)-PHENYL SUCCINIC ACID, CHEBI:225246

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LVFFZQQWIZURIO-UHFFFAOYSA-N

• 1-Tert-Butyl-2-Nitrobenzene
IUPAC Name: 1-tert-butyl-2-nitrobenzene | CAS Registry Number: 1886-57-3
Synonyms: 1-tert-Butyl-2-nitrobenzene, NSC43039, CID74674, EINECS 217-554-6, ZINC01675820, Benzene, 1-(1,1-dimethylethyl)-2-nitro-

Molecular Formula: C10H13NO2Molecular Weight: 179.215720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IWTHGPTVKBEURV-UHFFFAOYSA-N

• 10-undecyn-1-ol
IUPAC Name: undec-10-yn-1-ol | CAS Registry Number: 2774-84-7
Synonyms: 10-Undecyn-1-ol, 94195_FLUKA, ZINC01841027, CID76015, SBB009008

Molecular Formula: C11H20OMolecular Weight: 168.275900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YUQZOUNRPZBQJK-UHFFFAOYSA-N

• 1-Octane Sulphonic Acid Sodium Salt
IUPAC Name: sodium octane-1-sulfonate | CAS Registry Number: 5324-84-5
Synonyms: Sodium octylsulfonate, Sodium octanesulfonate, Sodium 1-octanesulfonate, sodium octane-1-sulfonate, O0133_SIAL, O8380_SIAL, 1-Octanesulfonic acid, sodium salt, 74886_FLUKA, Sodium 1-octanesulfonate solution, 1-Octanesulfonic acid sodium salt, NSC 2738, EINECS 226-195-4, Sodium octane-1-sulphonate monohydrate, 163883-56-5, 3944-72-7

Molecular Formula: C8H17NaO3SMolecular Weight: 216.273550 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HRQDCDQDOPSGBR-UHFFFAOYSA-M

• 1,3-Diiodobenzene
IUPAC Name: 1,3-diiodobenzene | CAS Registry Number: 626-00-6
Synonyms: m-Diiodobenzene, Benzene, m-diiodo-, Benzene, 1,3-diiodo-, 1,3-DIIODOBENZENE, 475262_ALDRICH, CID12270, EINECS 210-921-1, BBV-2090892, TL8004202

Molecular Formula: C6H4I2Molecular Weight: 329.904900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SFPQFQUXAJOWNF-UHFFFAOYSA-N

• 1-Cyclohexenyl Acetate
IUPAC Name: cyclohexen-1-yl acetate | CAS Registry Number: 1424-22-2
Synonyms: 1-Acetoxycyclohexene, 1-Cyclohexenyl acetate, Cyclohexen-1-ol acetate, 1-Cyclohexen-1-yl acetate, 1-Acetoxy-1-cyclohexene, Cyclohexene-1-yl acetate, cyclohex-1-en-1-yl acetate, 1-CYCLOHEXEN-1-OL, ACETATE, 454761_ALDRICH, CID74019, NSC18899, EINECS 215-838-4, NSC 18899, ZINC04684321, 1-Cyclohexen-1-ol, acetate (8CI)(9CI), EN300-42527, I14-1987, InChI=1/C8H12O2/c1-7(9)10-8-5-3-2-4-6-8/h5H,2-4,6H2,1H

Molecular Formula: C8H12O2Molecular Weight: 140.179680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DRJNNZMCOCQJGI-UHFFFAOYSA-N

• 1,2-Dianilinoethane
IUPAC Name: N,N'-di(phenyl)ethane-1,2-diamine | CAS Registry Number: 150-61-8
Synonyms: Stabilite, NODX, N,N'-Ethylenedianiline, N,N'-Diphenylethylenediamine, sym-Diphenylethylenediamine, Aniline, N,N'-ethylenedi-, Maybridge1_002161, WLN: RM2MR, Ethylenediamine, N,N'-diphenyl-, 1,2-Ethanediamine, N,N'-diphenyl-, 2-anilino-ethyl-phenyl-amine, D27004_ALDRICH, N,N'-Diphenyl-1,2-ethylenediamine, N,N'-Difenylethylendiamin [Czech], NSC 8719, Wanzlick's Reagent for aldehydes, EINECS 205-765-6, Benzenamine, N,N'-1,2-ethanediylbis-, NSC8719, AIDS455201

Molecular Formula: C14H16N2Molecular Weight: 212.290240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NOUUUQMKVOUUNR-UHFFFAOYSA-N

• (1s,2s)-2-Methoxycyclohexanol, Chipros
IUPAC Name: (1S,2S)-2-methoxycyclohexan-1-ol | CAS Registry Number: 134108-68-2
Synonyms: (1S,2S)-2-METHOXYCYCLOHEXANOL, 134108-92-2, (1S,2S)-(+)-2-Methoxycyclohexanol, ZINC00403380, SCHEMBL2429552, CTK0G9998, DCQQZLGQRIVCNH-BQBZGAKWSA-N, ZINC403380, (1alpha)-2beta-Methoxycyclohexanol, 6160AA, ANW-69506, MFCD00211253, WTI-10232, AKOS016843369, FCH1121369, Cyclohexanol, 2-methoxy-, (1S,2S)-, AJ-22063, AK-58207, KB-00810, OR137433

Molecular Formula: C7H14O2Molecular Weight: 130.187 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DCQQZLGQRIVCNH-BQBZGAKWSA-N

• 1-(2-Naphthyl)-3-(2-Thienyl)-2-Propen-1-One
IUPAC Name: (E)-1-naphthalen-2-yl-3-thiophen-2-ylprop-2-en-1-one | CAS Registry Number: 20894-63-7
Synonyms: 1-(2-Naphthyl)-3-(2-thienyl)prop-2-en-1-one, T5422098, (2E)-1-(2-Naphthyl)-3-(2-thienyl)-2-propen-1-one, ZINC04825154, AC1NTBIS, CHEMBL1945995, AKOS001097565, FT-0605555, (E)-1-(2-naphthyl)-3-(2-thienyl)prop-2-en-1-one, (E)-1-naphthalen-2-yl-3-thiophen-2-ylprop-2-en-1-one, 1-(naphthalen-2-yl)-3-(thiophen-2-yl)prop-2-en-1-one

Molecular Formula: C17H12OSMolecular Weight: 264.341580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LAPXFVWYPUWTMF-MDZDMXLPSA-N

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

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

InChIKey: NBGGEWGFZUDQKZ-UHFFFAOYSA-N

• 1,3-Dimethylbarbituric Acid
IUPAC Name: 1,3-dimethyl-1,3-diazinane-2,4,6-trione | CAS Registry Number: 769-42-6
Synonyms: 1,3-Dimethylbarbituric acid, N,N'-Dimethylbarbituric acid, Barbituric acid, 1,3-dimethyl-, 318000_ALDRICH, 39565_FLUKA, TOS-BB-1003, NSC61918, EINECS 212-211-7, NSC 61918, ZINC03008697, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-, 1,3-Dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione, ST5171030, TL8005287, AE-848/30739017, 1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione, 213833-88-6, 41949-07-9

Molecular Formula: C6H8N2O3Molecular Weight: 156.139320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VVSASNKOFCZVES-UHFFFAOYSA-N


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