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Shanghai Chunshin Chemical Co., Ltd.

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Profile: Shanghai Chunshin Chemical Co., Ltd manufactures chemical materials. Functional polymers include polyvinylpyrrolidone (PVP), crospovidone, 2-pyrrolidone, poycaprolactone, DL-pantoyllactone, 2-acetyl-ƒA-butyrolactone, _@ethly-2,3-dicyano propionate and azamethiphos. Polyvinylpyrrolidone is a white to yellowish white free flowing hygroscopic powder. It is soluble in ethanol and methanol. It is used as film-forming agent, viscosity-enhancement agent & adhesive for hair-care products, like mousses, hair sprays, gels & lotions, hair-dying reagent and shampoo. It is also used as lubricator for skin-care products like eye makeup, lipstick, deodorant, sunscreen and dentifrice.

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• 2,4-Diaminotoluene
IUPAC Name: 4-methylbenzene-1,3-diamine | CAS Registry Number: 95-80-7
Synonyms: Toluenediamine, Developer mtd, m-Toluenediamine, Fouramine, Fourrine M, m-Tolylenediamine, 2,4-Toluenediamine, Benzofur MT, Developer DBJ, Eucanine GB, Pelagol J, Tertral G, Pelagol Grey J, Developer MT-CF, Zogen developer H, Brown for Fur T, 2,4-Toluene diamine, Developer B, Developer T, Fouramine J

Molecular Formula: C7H10N2Molecular Weight: 122.167700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VOZKAJLKRJDJLL-UHFFFAOYSA-N

• 3,5-Dimethylisoxazole
IUPAC Name: 3,5-dimethyl-1,2-oxazole | CAS Registry Number: 300-87-8
Synonyms: Dimexazol, ISOXAZOLE, 3,5-DIMETHYL-, 3,5-Dimethylisooxazole, D167509_ALDRICH, 3,5-Dwumetyloizoksazolu [Polish], 79705_FLUKA, EINECS 206-100-2, NSC 40798, AIDS230598, AIDS-230598, ALD-N000007, NSC40798, BRN 0106324, U 21221, ZINC02504362, LS-86669, TL8007321, 4-27-00-00978 (Beilstein Handbook Reference), InChI=1/C5H7NO/c1-4-3-5(2)7-6-4/h3H,1-2H

Molecular Formula: C5H7NOMolecular Weight: 97.115180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FICAQKBMCKEFDI-UHFFFAOYSA-N

• 2-Methylpyrrolidine
IUPAC Name: 2-methylpyrrolidine | CAS Registry Number: 765-38-8
Synonyms: 2-METHYLPYRROLIDINE, Pyrrolidine, 2-methyl-, R(-)-2-Methyl-pyrrolidine, 478059_ALDRICH, AKE-BBV-050505, CID13003, EINECS 212-144-3, BBV-050505, C520125, 79171-53-2

Molecular Formula: C5H11NMolecular Weight: 85.147540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RGHPCLZJAFCTIK-UHFFFAOYSA-N

• 6-Hydroxy Indole
IUPAC Name: 1H-indol-6-ol | CAS Registry Number: 2380-86-1
Synonyms: 6-Hydroxyindole, 1H-indol-6-ol, ZINC00153921, CID524508, H2141G1, SL-02118, TL8001967, H-6060

Molecular Formula: C8H7NOMolecular Weight: 133.147280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XAWPKHNOFIWWNZ-UHFFFAOYSA-N

• 2-Fluoro Benzophenone
IUPAC Name: (2-fluorophenyl)-phenylmethanone | CAS Registry Number: 342-24-5
Synonyms: 2-Fluorobenzophenone, o-Fluorobenzophenone, NCIOpen2_001483, NSC88283, EINECS 206-440-1, ZINC01847555, ST5319360, TL8002548

Molecular Formula: C13H9FOMolecular Weight: 200.208363 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DWFDQVMFSLLMPE-UHFFFAOYSA-N

• 2-Hydroxyisobutyric Acid
IUPAC Name: 2-hydroxy-2-methylpropanoic acid | CAS Registry Number: 594-61-6
Synonyms: Acetonic acid, 2-Methyllactic acid, 2-HYDROXYISOBUTYRIC ACID, Hydroxydimethylacetic acid, 2-Hydroxy-2-methylpropanoic acid, alpha-Hydroxyisobutyric acid, 2-Hydroxy-2-methylpropionic acid, Lactic acid, 2-methyl-, Lactic acid, 2-methyl-, L-, alpha-Hydroxyisobutanoic acid, Propanoic acid, 2-hydroxy-2-methyl-, .alpha.-Hydroxyisobutyric acid, .alpha.-Hydroxyisobutanoic acid, 164976_ALDRICH, 323594_ALDRICH, CHEBI:50129, NSC4505, Lactic acid, 2-methyl- (8CI), CID11671, NSC 4505

Molecular Formula: C4H8O3Molecular Weight: 104.104520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BWLBGMIXKSTLSX-UHFFFAOYSA-N

• 2-Ethyl Chloro-Propionate
IUPAC Name: ethyl 2-chloropropanoate | CAS Registry Number: 535-13-7
Synonyms: Ethyl 2-chloropropionate, Ethyl 2-chloropropanoate, Ethyl .alpha.-chloropropionate, 192414_ALDRICH, Propanoic acid, 2-chloro-, ethyl ester, 2-Chloropropionic acid, ethyl ester, Propionic acid, 2-chloro-, ethyl ester, AIDS017657, ETHYL ALPHA-CHLOROPROPIONATE, AIDS-017657, EINECS 208-610-0, NSC522671, UN2935, NSC 522671, alpha -chloropropionic acid, ethyl ester, AI3-39182, ST5409191, Propionic acid, 2-chloro-, ethyl ester (8CI), Ethyl 2-chloropropionate [UN2935] [Flammable liquid], 105309-19-1

Molecular Formula: C5H9ClO2Molecular Weight: 136.576760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JEAVBVKAYUCPAQ-UHFFFAOYSA-N

• 1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride
IUPAC Name: 1-(3-chlorophenyl)-4-(3-chloropropyl)piperazin-1-ium chloride | CAS Registry Number: 52605-52-4
Synonyms: EINECS 258-038-0, 1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazinium chloride

Molecular Formula: C13H19Cl3N2Molecular Weight: 309.662360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JVLRNANYLVRULL-UHFFFAOYSA-N

• 4-Bromofluorobenzene
IUPAC Name: 1-bromo-4-fluorobenzene | CAS Registry Number: 460-00-4
Synonyms: p-Bromofluorobenzene, p-Fluorobromobenzene, 1-Bromo-4-fluorobenzene, 4-Fluorobromobenzene, p-Fluorophenyl bromide, 4-Fluorophenyl bromide, Benzene, 1-bromo-4-fluoro-, 1-Fluoro-4-bromobenzene, 4-Fluoro-1-bromobenzene, B67201_ALDRICH, 442404_SUPELCO, 1-BROMO-4-FLOUROBENZENE, 17080_FLUKA, EINECS 207-300-2, NSC9460, NSC 10268, NSC10268, NCGC00164249-01, B113, LS-29201

Molecular Formula: C6H4BrFMolecular Weight: 174.998363 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AITNMTXHTIIIBB-UHFFFAOYSA-N

• 2-Hydroxy Benzamide
IUPAC Name: 2-hydroxybenzamide | CAS Registry Number: 65-45-2
Synonyms: salicylamide, 2-Hydroxybenzamide, Algiamida, Dropsprin, Eggosalil, Flarpirina, Liquiprin, Morsarinas, Raspberin, Serramida, Amidosal, Cetamide, Dolomide, Panithal, Salamide, Saliamid, Saliamin, Salizell, Algamon, Allevin

Molecular Formula: C7H7NO2Molecular Weight: 137.135980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SKZKKFZAGNVIMN-UHFFFAOYSA-N

• 2-Methylthiopyrimidin-4-ol
IUPAC Name: 2-methylsulfanyl-1H-pyrimidin-6-one | CAS Registry Number: 5751-20-2
Synonyms: 2-Methylthiouracil, 2-(Methylthio)-4-pyrimidone, 4-Hydroxy-2-methylthiopyrimidine, 4(1H)-Pyrimidinone, 2-(methylthio)-, 2-(methylsulfanyl)pyrimidin-4-ol, 4-Pyrimidinol, 2-(methylthio)-, EINECS 227-274-6, 2-(Methylthio)-1H-pyrimidin-4-one, NSC125339, NSC165518, ZINC05037785, ST5188714, PB295540788, AC-907/30003037

Molecular Formula: C5H6N2OSMolecular Weight: 142.178940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UYHSQVMHSFXUOA-UHFFFAOYSA-N

• 2-Hydroxymethyl-3,4-dihydro-2H-pyran
IUPAC Name: 3,4-dihydro-2H-pyran-2-ylmethanol | CAS Registry Number: 3749-36-8
Synonyms: Ambap4948, 3,4-Dihydro-2H-pyran-2-methanol, NSC20753, 55665_FLUKA, CID95559, EINECS 223-150-0, 3,4-Dihydro-2H-pyran-2-ylmethanol, 2H-Pyran-2-methanol, 3,4-dihydro-, AI3-24752

Molecular Formula: C6H10O2Molecular Weight: 114.142400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XMICBFRKICBBKD-UHFFFAOYSA-N

• 4-Methoxybenzylamine
IUPAC Name: (4-methoxyphenyl)methanamine | CAS Registry Number: 2393-23-9
Synonyms: Anisylamine, Benzylamine der, p-Anisylamine, p-Methoxybenzylamine, Benzylamine, p-methoxy-, Benzenemethanamine, 4-methoxy-, Oprea1_248499, M11103_ALDRICH, 1-(4-methoxyphenyl)methanamine, Benzylamine, p-methoxy- (8CI), NSC9269, AIDS107188, AIDS-107188, NSC 9269, EINECS 219-247-2, 17061-61-9 (HYDROCHLORIDE), ST5213748, TL8001980, InChI=1/C8H11NO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,6,9H2,1H, PZM

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IDPURXSQCKYKIJ-UHFFFAOYSA-N

• 3-Pentanone
IUPAC Name: pentan-3-one | CAS Registry Number: 96-22-0
Synonyms: Diethyl ketone, Dimethylacetone, Methacetone, Metacetone, Propione, Ethyl ketone, 3-PENTANONE, Pentan-3-one, Pentanone-3, Ethyl propionyl, Diethylcetone, Diethylcetone [French], DIETHYLKETONE, HSDB 5301, W510106_ALDRICH, 127604_ALDRICH, 270334_ALDRICH, 345121_ALDRICH, WLN: 2V2, NSC 8653

Molecular Formula: C5H10OMolecular Weight: 86.132300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FDPIMTJIUBPUKL-UHFFFAOYSA-N

• 4-Butoxyphenol
IUPAC Name: 4-butoxyphenol | CAS Registry Number: 122-94-1
Synonyms: p-Butoxyphenol, Phenol, 4-butoxy-, Phenol, p-butoxy-, 4-BUTOXYPHENOL, Phenol, p-butoxy- (8CI), B87806_ALDRICH, CID31233, NSC60292, EINECS 204-583-4, NSC 60292, ZINC01690127, ST5406330, C14351

Molecular Formula: C10H14O2Molecular Weight: 166.216960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MBGGFXOXUIDRJD-UHFFFAOYSA-N

• 3-Pyrroline
IUPAC Name: 2,5-dihydro-1H-pyrrole | CAS Registry Number: 109-96-6
Synonyms: 2,5-Dihydropyrrole, delta3-Pyrroline, Delta(3)-pyrroline, 2,5-Dihydro-1H-pyrrole, 1H-Pyrrole, 2,5-dihydro-, .DELTA.3-Pyrroline, P75903_ALDRICH, 377112_ALDRICH, 83310_FLUKA, CHEBI:20198, ALBB-006223, NSC89295, EINECS 203-723-1, NSC 89295

Molecular Formula: C4H7NMolecular Weight: 69.105080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JVQIKJMSUIMUDI-UHFFFAOYSA-N

• 3 Bromophenol
IUPAC Name: 3-bromophenol | CAS Registry Number: 591-20-8
Synonyms: m-Bromophenol, Phenol, 3-bromo-, 3-BROMOPHENOL, Phenol, m-bromo-, Ambap1480, 101079_ALDRICH, EINECS 209-706-5, ZINC00388034, TL80073617, InChI=1/C6H5BrO/c7-5-2-1-3-6(8)4-5/h1-4,8

Molecular Formula: C6H5BrOMolecular Weight: 173.007300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MNOJRWOWILAHAV-UHFFFAOYSA-N

• 3,4,5-Trichlorobenzotrifluoride
IUPAC Name: 1,2,3-trichloro-5-(trifluoromethyl)benzene | CAS Registry Number: 50594-82-6
Synonyms: EINECS 256-636-6, T109, ST5405198, 1,2,3-Trichloro-5-(trifluoromethyl)benzene, InChI=1/C7H2Cl3F3/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2

Molecular Formula: C7H2Cl3F3Molecular Weight: 249.444990 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: FBKFIAIRSQOXJR-UHFFFAOYSA-N

• 2,3-Dichlorobenzaldehyde
IUPAC Name: 2,3-dichlorobenzaldehyde | CAS Registry Number: 6334-18-5
Synonyms: Benzaldehyde, dichloro-, Benzaldehyde, 2,3-dichloro-, DICHLOROBENZALDEHYDE, 254835_ALDRICH, 35248_FLUKA, NSC28450, EINECS 228-711-3, EINECS 250-492-8, NSC 28450, SBB003792, ZINC02539302, AK-968/41169414, 31155-09-6

Molecular Formula: C7H4Cl2OMolecular Weight: 175.012060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LLMLNAVBOAMOEE-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

• 3-Fluoro Nitro Benzene
IUPAC Name: 1-fluoro-3-nitrobenzene | CAS Registry Number: 402-67-5
Synonyms: m-Fluoronitrobenzene, m-Nitrofluorobenzene, 3-Fluoronitrobenzene, Benzene, 1-fluoro-3-nitro-, 1-FLUORO-3-NITROBENZENE, 128392_ALDRICH, 47160_FLUKA, NSC60651, EINECS 206-953-0, NSC 60651, ZINC01690401, TL8002925, Benzene, 1-fluoro-3-nitro- (8CI)(9CI), InChI=1/C6H4FNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4

Molecular Formula: C6H4FNO2Molecular Weight: 141.099863 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WMASLRCNNKMRFP-UHFFFAOYSA-N

• 4-Cyanophenol
IUPAC Name: 4-hydroxybenzonitrile | CAS Registry Number: 767-00-0
Synonyms: 4-Hydroxybenzonitrile, p-Hydroxybenzonitrile, P-CYANOPHENOL, Benzonitrile, 4-hydroxy-, Benzonitrile, p-hydroxy-, phenol derivative, 10, WLN: QR DCN, C7H5NO, C94009_ALDRICH, 4-Hydroxybenzoic acid nitrile, 45528_RIEDEL, 54797_FLUKA, CHEBI:38622, EINECS 212-175-2, NSC 400524, NSC400524, SBB008054, ZINC00388759, 4-HYDROXY-BENZOIC ACID,NITRILE, AI3-52392

Molecular Formula: C7H5NOMolecular Weight: 119.120700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CVNOWLNNPYYEOH-UHFFFAOYSA-N

• 2-Oxopentane
IUPAC Name: pentan-2-one | CAS Registry Number: 107-87-9
Synonyms: 2-Pentanone, Ethyl acetone, Ethylacetone, PENTAN-2-ONE, Pentanone, Propyl methyl ketone, Methylpropyl ketone, METHYL PROPYL KETONE, Metylopropyloketon, Methyl n-propyl ketone, Methyl-propyl-cetone, 2-Pentanone (natural), FEMA Number 2842, Methyl-n-propyl ketone, Metylopropyloketon [Polish], Methyl-propyl-cetone [French], FEMA No. 2842, HSDB 158, W284203_ALDRICH, 46211_RIEDEL

Molecular Formula: C5H10OMolecular Weight: 86.132300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XNLICIUVMPYHGG-UHFFFAOYSA-N

• 2-(2h-Benzotriazol-2-Yl)-4,6-Bis(1-Methyl-1-Phenylethyl)phenol
IUPAC Name: 2-(benzotriazol-2-yl)-4,6-bis(2-phenylpropan-2-yl)phenol | CAS Registry Number: 70321-86-7
Synonyms: 535753_ALDRICH, EINECS 274-570-6, CID112412, ZINC02504746, NCGC00164197-01, 2-(2H-Benzotriazol-2-yl)-4,6-bis(1-methyl-1-phenylethyl)phenol, Phenol, 2-(2H-benzotriazol-2-yl)-4,6-bis(1-methyl-1-phenylethyl)-, 134531-15-0, 147614-31-1, 796971-91-0, 83931-73-1, 88653-64-9

Molecular Formula: C30H29N3OMolecular Weight: 447.570760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OLFNXLXEGXRUOI-UHFFFAOYSA-N

• 2-Bromo-4'-Chloroacetophenone
IUPAC Name: 2-bromo-1-(4-chlorophenyl)ethanone | CAS Registry Number: 536-38-9
Synonyms: p-Chlorophenacyl bromide, 4'-Chlorophenacyl bromide, 4-Chlorophenacyl bromide, 2-Bromo-4'-chloroacetophenone, 2-Bromo-p-chloroacetophenone, Bromomethyl p-chlorophenyl ketone, p-(Bromoacetyl)chlorobenzene, Acetophenone, 2-bromo-4'-chloro-, omega-Bromo-p-chloroacetophenone, p-Chloro-omega-bromoacetophenone, 4-Chloro-omega-bromoacetophenone, alpha-Bromo-4'-chloroacetophenone, 101273_ALDRICH, alpha-Bromo-p-chloroacetophenone, Ethanone, 2-bromo-1-(4-chlorophenyl)-, NSC 8452, omega-Bromo-4-chloroacetophenone, EINECS 208-631-5, NSC8452, .alpha.-Bromo-p-chloroacetophenone

Molecular Formula: C8H6BrClOMolecular Weight: 233.489640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FLAYZKKEOIAALB-UHFFFAOYSA-N

• 3,5-Dimethoxybenzoic Acid
IUPAC Name: 3,5-dimethoxybenzoic acid | CAS Registry Number: 1132-21-4
Synonyms: 3,5-DIMETHOXYBENZOIC ACID, Benzoic acid, 3,5-dimethoxy-, D132004_ALDRICH, NSC8514, AIDS018092, AIDS-018092, NSC 8514, NSC43744, EINECS 214-473-8, NSC 43744, SBB007798, AI3-52341, TL8000393, AK-968/40724491, InChI=1/C9H10O4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H,10,11

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IWPZKOJSYQZABD-UHFFFAOYSA-N

• 4-Amino-2-Chloro-6,7-Dimethoxy Quinazoline
IUPAC Name: 2-chloro-6,7-dimethoxyquinazolin-4-amine | CAS Registry Number: 23680-84-4
Synonyms: 518654_ALDRICH, 4-Amino-2-chloro-6,7-dimethoxyquinazoline, ZINC02028665, ALBB-005949, CID90235, EINECS 245-821-7, SBB000787, 2-Chloro-6,7-dimethoxy-4-quinazolinamine, 2-Chloro-6,7-dimethoxyquinazolin-4-amine, 4-Quinazolinamine, 2-chloro-6,7-dimethoxy-, 2-chloro-6,7-dimethoxyquinazolin-4-ylamine, TL8001956, AN-829/25042011

Molecular Formula: C10H10ClN3O2Molecular Weight: 239.658300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: HWIIAAVGRHKSOJ-UHFFFAOYSA-N

• 2,3-Dibromo Propionyl Chloride
IUPAC Name: 2,3-dibromopropanoyl chloride | CAS Registry Number: 18791-02-1
Synonyms: 2,3-Dibromopropionyl chloride, 2,3-Dibromopropanoyl chloride, 300373_ALDRICH, Propionyl chloride, 2,3-dibromo-, alpha,beta-Dibromopropionyl chloride, EINECS 242-575-2, Propanoyl chloride, 2,3-dibromo-, BRN 1749801, Propanoyl chloride, 2,3-dibromo- (9CI), LS-125026, 3-02-00-00572 (Beilstein Handbook Reference)

Molecular Formula: C3H3Br2ClOMolecular Weight: 250.316320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HWKWYDXHMQQDQJ-UHFFFAOYSA-N

• (+)-Monocalciumbis{(3r,5s,6e)-7-[2-Cyclopropyl-4-(4-Fluorophenyl)-3-Quinolyl]-3,5-Dihydroxy-6-Heptenoate}
IUPAC Name: calcium (E,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate | CAS Registry Number: 147526-32-7
Synonyms: Livalo, Nisvastatin, Itavastatin, Pitavastatin, Pitavastatin calcium, Itavastatin calcium, Livalo (TN), Pitavastatin hemicalcium, Pitavastatin calcium (JAN), 2C25H23FNO4.Ca, NK 104, NK-104, NKS-104, CID5282451, LS-74595, D01862, P 872441, P-872441, 6-Heptenoic acid, 7-(2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl)-3,5-dihydroxy-, calcium salt (2:1), (S-(R*,S*-(E)))-, Bis((3R,5S,6E)-7-(2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl)-3,5-dihydroxy-6-heptenoate), monocalcium salt

Molecular Formula: C50H46CaF2N2O8Molecular Weight: 880.983646 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 12

InChIKey: RHGYHLPFVJEAOC-FFNUKLMVSA-L

• 4'-Hydroxy Acetophenone
IUPAC Name: 1-(4-hydroxyphenyl)ethanone | CAS Registry Number: 99-93-4
Synonyms: Piceol, 4'-Hydroxyacetophenone, 4-Acetylphenol, 4-Hydroxyacetophenone, p-Oxyacetophenone, p-Acetylphenol, P-HYDROXYACETOPHENONE, 1-(4-Hydroxyphenyl)ethanone, Phenol, p-acetyl-, para-Hydroxyacetophenone, Acetophenone, 4'-hydroxy-, p-Hydroxacetophenone, Acetophenone, p-hydroxy-, Ethanone, 1-(4-hydroxyphenyl)-, Methyl p-hydroxyphenyl ketone, p-hydroxyaceto-phenone, p-Hydroxyphenyl methyl ketone, 4-hydroxyaceto-phenone, USAF KF-15, (4-Hydroxyphenyl)ethan-1-one

Molecular Formula: C8H8O2Molecular Weight: 136.147920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: TXFPEBPIARQUIG-UHFFFAOYSA-N

• 3,4-Dihydroxy benzonitrile
IUPAC Name: 3,4-dihydroxybenzonitrile | CAS Registry Number: 17345-61-8
Synonyms: Protocatechuonitrile, 3,4-Dihydroxybenzonitrile, 538396_ALDRICH, EINECS 241-367-9, SBB008582, ZINC00157092, FR-2291, TL8001371

Molecular Formula: C7H5NO2Molecular Weight: 135.120100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NUWHYWYSMAPBHK-UHFFFAOYSA-N

• 1 Phenyl 3 Methyl 5 Pyrazolone
IUPAC Name: 5-methyl-2-phenyl-4H-pyrazol-3-one | CAS Registry Number: 89-25-8
Synonyms: edaravone, Norphenazone, Radicut, Norantipyrine, Developer Z, edarabone, Methylphenylpyrazolone, Phenylmethylpyrazolone, C.I. Developer 1, CI Developer 1, Phenyl methyl pyrazolone, Radicut (TN), 1-Phenyl-3-methyl-5-pyrazolone, 1-Phenyl-3-methylpyrazolone, Spectrum_000267, Tocris-0786, MCI-186, Edaravone (JAN/INN), 3-Methyl-1-phenyl-5-pyrazolone, Maybridge1_005738

Molecular Formula: C10H10N2OMolecular Weight: 174.199200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QELUYTUMUWHWMC-UHFFFAOYSA-N

• 3,4-Dimethoxybenzaldehyde
IUPAC Name: 3,4-dimethoxybenzaldehyde | CAS Registry Number: 120-14-9
Synonyms: VERATRALDEHYDE, Methylvanillin, Veratric aldehyde, Veratral, Veratryl aldehyde, Veratrum aldehyde, Vanillin methyl ether, p-Veratric aldehyde, 4-O-Methylvanillin, Benzaldehyde, 3,4-dimethoxy-, 3,4-Dimethoxybenzenecarbonal, FEMA No. 3109, CCRIS 6285, Protocatechualdehyde dimethyl ether, WLN: VHR CO1 DO1, W310905_ALDRICH, 143758_ALDRICH, Protocatechuic aldehyde dimethyl ether, 94860_FLUKA, CHEBI:17098

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WJUFSDZVCOTFON-UHFFFAOYSA-N

• 3-Ethoxy Propyl Amine
IUPAC Name: 3-ethoxypropan-1-amine | CAS Registry Number: 6291-85-6
Synonyms: 3-Ethoxypropylamine, 1-Propanamine, 3-ethoxy-, 3-Ethoxy-1-propylamine, 3-Ethoxy-1-propanamine, PROPYLAMINE, 3-ETHOXY-, WLN: Z3O2, NSC8162, 239437_ALDRICH, NSC 8162, 02800_FLUKA, EINECS 228-545-1, CID22720, BRN 1732287, LS-125688, 4-04-00-01623 (Beilstein Handbook Reference)

Molecular Formula: C5H13NOMolecular Weight: 103.162820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SOYBEXQHNURCGE-UHFFFAOYSA-N

• 3,4-Difluoronitrobenzene
IUPAC Name: 1,2-difluoro-4-nitrobenzene | CAS Registry Number: 369-34-6
Synonyms: 1,2-Difluoro-4-nitrobenzene, Ambap1719, Benzene, 1,2-difluoro-4-nitro-, 288365_ALDRICH, EINECS 206-718-2, BRN 1944996, ZINC00152925, D129, LS-29842, TL8002726, 4-05-00-00720 (Beilstein Handbook Reference)

Molecular Formula: C6H3F2NO2Molecular Weight: 159.090326 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RUBQQRMAWLSCCJ-UHFFFAOYSA-N

• 3,5-Di tert Butyl Salicylic Acid
IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzoic acid | CAS Registry Number: 19715-19-6
Synonyms: 3,5-Bis-tert-butylsalicylic acid, 149136_ALDRICH, 3,5-Di-tert-butylsalicylic acid, EINECS 243-246-6, 3,5-Di-tert-butylsalicylic acid hydrate, ST5409794, TL8001612, 3,2-Bis(1,1-dimethylethyl)-2-hydroxybenzoic acid, Benzoic acid, 3,5-bis(1,1-dimethylethyl)-2-hydroxy-, Benzoic acid, 3,5-bis(1,1-dimethylethyl)-2-hydroxy-, monopotassium salt, 96247-23-3, InChI=1/C15H22O3/c1-14(2,3)9-7-10(13(17)18)12(16)11(8-9)15(4,5)6/h7-8,16H,1-6H3,(H,17,18

Molecular Formula: C15H22O3Molecular Weight: 250.333380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZWQBZEFLFSFEOS-UHFFFAOYSA-N

• 1-Pyrrolidinoethanol
IUPAC Name: 2-pyrrolidin-1-ylethanol | CAS Registry Number: 2955-88-6
Synonyms: 1-Pyrrolidineethanol, Epolamine, 2-Pyrrolidinoethanol, Pyrrolidinoethanol, Hydroxyethylpyrrolidine, 2-Pyrrolidin-1-ylethanol, Pyrrolidine-1-ethanol, 1-(2-Hydroxyethyl)pyrrolidine, 2-(1-Pyrrolidino)ethanol, 2-(1-Pyrrolidinyl)ethanol, N-(2-Hydroxyethyl)pyrrolidine, 2-(pyrrolidin-1-yl)ethanol, H29404_ALDRICH, N-(beta-Hydroxyethyl)pyrrolidine, N-.beta.-Hydroxyethylpyrrolidine, N-beta-Hydroxyethylpyrrolidine, CHEBI:48293, EINECS 220-976-3, NSC26883, AI3-62298

Molecular Formula: C6H13NOMolecular Weight: 115.173520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XBRDBODLCHKXHI-UHFFFAOYSA-N

• 4-Ethoxy ethylbenzoate
IUPAC Name: ethyl 4-ethoxybenzoate | CAS Registry Number: 23676-09-7
Synonyms: Ethyl 4-ethoxybenzoate, Benzoic acid, 4-ethoxy-, ethyl ester, Benzoic acid, p-ethoxy-, ethyl ester, EINECS 245-818-0, NSC405367, ZINC01598332, NSC 405367, AI3-20315, ST5406031, InChI=1/C11H14O3/c1-3-13-10-7-5-9(6-8-10)11(12)14-4-2/h5-8H,3-4H2,1-2H

Molecular Formula: C11H14O3Molecular Weight: 194.227060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HRAQMGWTPNOILP-UHFFFAOYSA-N

• 3-Phenyl Propanoic Acid Ethyl Ester
IUPAC Name: ethyl 3-phenylpropanoate | CAS Registry Number: 2021-28-5
Synonyms: Ethyl hydrocinnamate, Ethyl dihydrocinnamate, Ethylhydrocinnamoate, Ethyl 3-phenylpropanoate, Ethyl 3-phenylpropionate, Hydrocinnamic acid, ethyl ester, Benzenepropanoic acid, ethyl ester, ETHYL BENZENEPROPANOATE, W245518_ALDRICH, FEMA No. 2455, 284416_ALDRICH, 56675_FLUKA, EINECS 217-966-6, NSC126040, ZINC00058257, Hydrocinnamic acid, ethyl ester (8CI), NSC 126040, AI3-11591, ST5331803, InChI=1/C11H14O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H

Molecular Formula: C11H14O2Molecular Weight: 178.227660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JAGZUIGGHGTFHO-UHFFFAOYSA-N

• 2(3,5-Dihydroxy) Benzoic Acid
IUPAC Name: 3,5-dihydroxybenzoic acid | CAS Registry Number: 99-10-5
Synonyms: alpha-Resorcylic acid, 5-Carboxyresorcinol, 3,5-DIHYDROXYBENZOIC ACID, .alpha.-Resorcylic acid, Benzoic acid, 3,5-dihydroxy-, Ambap1483, 3,5-DIHYDROXYBENZOATE, D110000_ALDRICH, EINECS 202-730-7, NSC 22948, AIDS018063, AIDS-018063, NSC22948, BRN 2207864, AI3-52338, LS-143431, TL8006060, 4-10-00-01501 (Beilstein Handbook Reference), 34D, InChI=1/C7H6O4/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,8-9H,(H,10,11

Molecular Formula: C7H6O4Molecular Weight: 154.120140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UYEMGAFJOZZIFP-UHFFFAOYSA-N

• 1,4-bis(benzoxazolyl-2-yl)-naphthalene
IUPAC Name: 2-[4-(1,3-benzoxazol-2-yl)naphthalen-1-yl]-1,3-benzoxazole | CAS Registry Number: 5089-22-5
Synonyms: Oprea1_504830, CBDivE_007888, ZINC02490582, CID78769, EINECS 225-803-5, 2,2'-(Naphthalene-1,4-diyl)bis(benzoxazole), Benzoxazole, 2,2'-(1,4-naphthalenediyl)bis-

Molecular Formula: C24H14N2O2Molecular Weight: 362.380160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WFYSPVCBIJCZPX-UHFFFAOYSA-N

• 3-Methoxy Propylamine
IUPAC Name: 3-methoxypropan-1-amine | CAS Registry Number: 5332-73-0
Synonyms: 3-Methoxypropylamine, 1-Propanamine, 3-methoxy-, 3-Methyoxypropylamine, Propylamine, 3-methoxy-, 1-Amino-3-methoxypropane, 3-Methoxy-n-propylamine, 3-Methoxy-1-propanamine, gamma-Methoxypropylamine, 3 -Methoxypropylamine, 3-Aminopropyl methyl ether, 3-methoxypropan-1-amine, Propanolamine methyl ether, 3-MPA, .gamma.-Methoxypropylamine, CCRIS 6178, M25007_ALDRICH, WLN: Z3O1, NSC 552, NSC552, 65309_FLUKA

Molecular Formula: C4H11NOMolecular Weight: 89.136240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FAXDZWQIWUSWJH-UHFFFAOYSA-N

• 2-(2-Aminoethyl)-2-methylpyrrolldine
IUPAC Name: 2-(1-methylpyrrolidin-2-yl)ethanamine | CAS Registry Number: 51387-90-7
Synonyms: 139505_ALDRICH, 2-(2-Aminoethyl)-1-methylpyrrolidine, 1-Methylpyrrolidine-2-ethylamine, 2-Pyrrolidineethanamine, 1-methyl-, EINECS 257-169-0, NSC118052

Molecular Formula: C7H16N2Molecular Weight: 128.215340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PNHGJPJOMCXSKN-UHFFFAOYSA-N

• 4-Chloro-3,5-diaminobenzoic Acid
IUPAC Name: 2-methylpropyl 3,5-diamino-4-chlorobenzoate | CAS Registry Number: 32961-44-7
Synonyms: Oprea1_570944, 544949_ALDRICH, EINECS 251-311-5, Isobutyl 4-chloro-3,5-diaminobenzoate, SBB003200, ZINC00404063, Isobutyl 3,5-diamino-4-chlorobenzoate, LS-166714, Benzoic acid, 3,5-diamino-4-chloro-, 2-methylpropyl ester, 100156-97-6

Molecular Formula: C11H15ClN2O2Molecular Weight: 242.702000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KHUIRIRTZCOEMK-UHFFFAOYSA-N

• 2-Ethylhexyloxypropylamine
IUPAC Name: 3-(2-ethylhexoxy)propan-1-amine | CAS Registry Number: 5397-31-9
Synonyms: 3-(2-Ethylhexoxy)propylamine, 3-(2-Ethylhexyloxy)propylamine, 2-Ethylhexyl 3-aminopropyl ether, CCRIS 4648, Propylamine, 3-(2-ethylhexoxy)-, 2-(Ethylhexyloxy)propylamine, 3-((2-Ethylhexyl)oxy)propylamine, NSC1078, 542431_ALDRICH, NSC 1078, EINECS 226-420-6, 3-(2-Ethylhexyloxy)-propylamine, 3-[(2-Ethylhexyl)oxy]propylamine, 3-((ETHYLHEXYL)OXY)PROPYLAMINE, CID21499, Propylamine, 3-((2-ethylhexyl)oxy)-, BRN 1740535, 1-Propanamine, 3-((2-ethylhexyl)oxy)-, 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, 3-[(2-ethylhexyl)oxy]propan-1-amine

Molecular Formula: C11H25NOMolecular Weight: 187.322300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DVFGEIYOLIFSRX-UHFFFAOYSA-N

• 5-Benzyloxyindole
IUPAC Name: 5-(phenylmethoxy)-1H-indole | CAS Registry Number: 1215-59-4
Synonyms: 5-(Benzyloxy)indole, Benzyloxy-5 indole, 5-Benzyloxy-1H-indole, 1H-Indole, 5-(phenylmethoxy)-, Maybridge3_006788, Indole, 5-(benzyloxy)-, Benzyloxy-5 indole [French], INDOLE, 5-BENZYLOXY-, Oprea1_825327, B27803_ALDRICH, WLN: T56 BMJ GO1R, EINECS 214-930-1, NSC 62895, NSC62895, BRN 0173532, SBB003331, ZINC00129178, B2318G1, IDI1_018175, 1H-Indole, 5-(phenylmethoxy)- (9CI)

Molecular Formula: C15H13NOMolecular Weight: 223.269820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JCQLPDZCNSVBMS-UHFFFAOYSA-N

• 2-Methyl-5-nitro-6-chlorophenol
IUPAC Name: 2-chloro-6-methyl-3-nitrophenol | CAS Registry Number: 39183-20-5
Synonyms: 2-Methyl-5-Nitro-6-Chlorophenol, 2-chloro-6-methyl-3-nitrophenol, 6-chloro-5-nitro-o-cresol, SBB064092, SureCN10485141, KSC496C9T, Jsp006809, CTK3J6199, MolPort-001-770-152, 2-Chloro-6-methyl-3-nitro-phenol, 2-Chloro-6-methyl-3-nitrophenol;, AC-617, ANW-51651, FC0820, ZINC02580756, 2-chloranyl-6-methyl-3-nitro-phenol, AKOS006346028, AB14699, AG-F-38313, RP24752

Molecular Formula: C7H6ClNO3Molecular Weight: 187.580440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FYPOFAFXSGYVLK-UHFFFAOYSA-N

• 2-Chloro-5-Nitrobenzoic Acid
IUPAC Name: 2-chloro-5-nitrobenzoic acid | CAS Registry Number: 2516-96-3
Synonyms: 2-CHLORO-5-NITROBENZOIC ACID, Benzoic acid, 2-chloro-5-nitro-, 6-Chloro-3-nitrobenzoic acid, 125113_ALDRICH, NSC8441, AIDS019398, BB_SC-2802, AIDS-019398, NSC 8441, EINECS 219-739-7, 2-CHLORO,5-NITRO-BENZOIC ACID, AI3-16578, TL8002047, InChI=1/C7H4ClNO4/c8-6-2-1-4(9(12)13)3-5(6)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4ClNO4Molecular Weight: 201.563960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QUEKGYQTRJVEQC-UHFFFAOYSA-N

• 4,4' Difluorobenzophenone
IUPAC Name: bis(4-fluorophenyl)methanone | CAS Registry Number: 345-92-6
Synonyms: 4,4'-Difluorobenzophenone, Di-p-fluorophenyl ketone, p,p'-Difluorobenzophenone, Bis(4-fluorophenyl)methanone, Bis(p-fluorophenyl) ketone, Bis(4-fluorophenyl) ketone, Methanone, bis(4-fluorophenyl)-, WLN: FR DVR DF, 115495_ALDRICH, BENZOPHENONE, 4,4'-DIFLUORO-, EINECS 206-466-3, NSC 51800, NSC51800, BRN 0516231, ZINC00105200, Methanone, bis(4-fluorophenyl)- (9CI), LS-38902, ST5307998, TL8002577, 4-07-00-01374 (Beilstein Handbook Reference)

Molecular Formula: C13H8F2OMolecular Weight: 218.198826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LSQARZALBDFYQZ-UHFFFAOYSA-N

• 2,4,6-Trimethybromombenzene
IUPAC Name: 2-bromo-1,3,5-trimethylbenzene | CAS Registry Number: 576-83-0
Synonyms: Mesityl bromide, 2-Bromomesitylene, Bromomesitylene, Mesitylene, 2-bromo-, 2,4,6-Trimethylbromobenzene, 2,4,6-Trimethylphenyl bromide, B71608_ALDRICH, Benzene, 2-bromo-1,3,5-trimethyl-, 1-Bromo-2,4,6-trimethylbenzene, 2-Bromo-1,3,5-trimethylbenzene, Mesitylene, 2-bromo- (8CI), NSC8064, CID68473, NSC 8064, EINECS 209-405-9, BBV-095136, FR-0690, AI3-07033, TL80090603, S01-0408

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

InChIKey: RRTLQRYOJOSPEA-UHFFFAOYSA-N


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