Carboxylic acids and derivatives
2-Sulfobenzoic acid cyclic anhydride, 95%
CAS: 81-08-3 Molecular Formula: C7H4O4S Molecular Weight (g/mol): 184.17 MDL Number: MFCD00005879 InChI Key: NCYNKWQXFADUOZ-UHFFFAOYSA-N Synonym: 2-sulfobenzoic anhydride,2-sulfobenzoic acid cyclic anhydride,sulfobenzoic anhydride,o-sulfobenzoic acid anhydride,3h-2,1-benzoxathiol-3-one, 1,1-dioxide,3h-benzo c 1,2 oxathiol-3-one 1,1-dioxide,unii-0swh68iq5w,o-sulfobenzoic acid, cyclic anhydride,2,1-benzoxathiol-3-one-1,1-dioxide,0swh68iq5w PubChem CID: 65729 IUPAC Name: 1,1-dioxo-2,1$l^{6}-benzoxathiol-3-one SMILES: C1=CC=C2C(=C1)C(=O)OS2(=O)=O
4-Phenylbutyric acid, 99%
CAS: 1821-12-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.2 InChI Key: OBKXEAXTFZPCHS-UHFFFAOYSA-N Synonym: 4-phenylbutyric acid,benzenebutanoic acid,benzenebutyric acid,phenylbutyrate,gamma-phenylbutyric acid,omega-phenylbutanoic acid,phenylbutyric acid,4-phenylbutyrate,butyric acid, 4-phenyl,4-phenyl-n-butyric acid PubChem CID: 4775 ChEBI: CHEBI:41500 IUPAC Name: 4-phenylbutanoic acid SMILES: C1=CC=C(C=C1)CCCC(=O)O
DL-Mercaptosuccinic acid, 99%
CAS: 70-49-5 Molecular Formula: C4H6O4S Molecular Weight (g/mol): 150.15 InChI Key: NJRXVEJTAYWCQJ-UHFFFAOYSA-N Synonym: mercaptosuccinic acid,thiomalic acid,2-thiomalic acid,2-mercaptosuccinic acid,monomercaptosuccinic acid,butanedioic acid, mercapto,malic acid, 2-thio,mercaptosuccinate,2-sulfanylsuccinic acid,dl-mercaptosuccinic acid PubChem CID: 6268 ChEBI: CHEBI:38705 IUPAC Name: 2-sulfanylbutanedioic acid SMILES: C(C(C(=O)O)S)C(=O)O
Cyclopentylacetic acid, 97%
CAS: 1123-00-8 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00001387 InChI Key: YVHAIVPPUIZFBA-UHFFFAOYSA-N Synonym: cyclopentylacetic acid,cyclopentaneacetic acid,cycylopentylacetic acid,carboxymethyl cyclopentane,cyclopentyl acetic acid,cyclopentyacetic acid,cyclopentanacetic acid,cyclopentyl-acetic acid,2-cyclopentylaceticacid,cyclopentane acetic acid PubChem CID: 71606 IUPAC Name: 2-cyclopentylacetic acid SMILES: OC(=O)CC1CCCC1
L(+)-Tartaric acid diammonium salt, 99%
CAS: 3164-29-2 Molecular Formula: C4H12N2O6 Molecular Weight (g/mol): 184.15 MDL Number: MFCD00013073 InChI Key: NGPGDYLVALNKEG-OLXYHTOASA-N Synonym: ammonium d-tartrate,diammonium l-+-tartrate,l-tartaric acid, ammonium salt,unii-ji8ud88354,diammonium l-tartrate,r-2,3-dihydroxybutanedioic acid diammonium salt,ammonium tartrate dibasic,butanedioic acid, 2,3-dihydroxy-2r,3r-, diammonium salt,ammonium l-+-tartrate,diammonium 2r,3r-2,3-dihydroxysuccinate PubChem CID: 13652278 ChEBI: CHEBI:63075 SMILES: N.N.O[C@H]([C@@H](O)C(O)=O)C(O)=O
Dimethyl fumarate, 99%
CAS: 624-49-7 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.13 MDL Number: MFCD00064438 InChI Key: LDCRTTXIJACKKU-ONEGZZNKSA-N Synonym: dimethyl fumarate,tecfidera,e-dimethyl fumarate,fumaderm,dimethyl e-but-2-enedioate,fumaric acid, dimethyl ester,boletic acid dimethyl ester,fumaric acid dimethyl ester,methyl fumarate,dimethyl trans-ethylenedicarboxylate PubChem CID: 637568 ChEBI: CHEBI:76004 IUPAC Name: dimethyl (E)-but-2-enedioate SMILES: COC(=O)C=CC(=O)OC
D-Gluconic acid, calcium salt, 99%
CAS: 299-28-5 Molecular Formula: C12H22CaO14 Molecular Weight (g/mol): 430.372 MDL Number: MFCD00064209 InChI Key: NEEHYRZPVYRGPP-IYEMJOQQSA-L Synonym: calcium gluconate,calcium d-gluconate,calciofon,calglucon,glucobiogen,ebucin,calcicol,calcipur,calglucol,dragocal PubChem CID: 9290 IUPAC Name: calcium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate SMILES: C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Ca+2]
Trifluoroacetic acid, ammonium salt, 98%
CAS: 3336-58-1 Molecular Formula: C2H5F3NO2 Molecular Weight (g/mol): 132.06 MDL Number: MFCD00012615,MFCD03095537 InChI Key: YCNIBOIOWCTRCL-UHFFFAOYSA-O Synonym: ammonium trifluoroacetate,azanium 2,2,2-trifluoroacetate,ammoniumtrifluoroacetate,ammonium triflouroacetate,cf3coonh4,acmc-1cq68,2,2,2-trifluoroacetic acid, azamethane,acetic acid, trifluoro-, ammonium salt 8ci 9ci PubChem CID: 86601334 IUPAC Name: azanium;2,2,2-trifluoroacetic acid SMILES: [NH4+].OC(=O)C(F)(F)F
L-Dihydroorotic acid, 98%
CAS: 5988-19-2 Molecular Formula: C5H6N2O4 Molecular Weight (g/mol): 158.113 MDL Number: MFCD00085339 InChI Key: UFIVEPVSAGBUSI-REOHCLBHSA-N Synonym: l-dihydroorotic acid,s-2,6-dioxohexahydropyrimidine-4-carboxylic acid,l-dihydroorotate,dihydro-l-orotic acid,s-dihydroorotic acid,l-hydroorotic acid,s-dihydroorotate,hydroorotic acid, l,4s-2,6-dioxo-1,3-diazinane-4-carboxylic acid,s-4,5-dihydroorotate PubChem CID: 439216 ChEBI: CHEBI:17025 IUPAC Name: (4S)-2,6-dioxo-1,3-diazinane-4-carboxylic acid SMILES: C1C(NC(=O)NC1=O)C(=O)O
3,4,6-Tri-O-benzoyl-D-glucal, 97%
CAS: 13322-90-2 Molecular Formula: C27H22O7 Molecular Weight (g/mol): 458.466 MDL Number: MFCD00061643 InChI Key: OZFFEFRJEYIEGH-SMIHKQSGSA-N Synonym: 3,4,6-tri-o-benzoyl-d-glucal,tri-o-benzoyl-d-glucal,1,2-dideoxy-d-arabino-1-hexenopyranose 3,4,6-tribenzoate,2r,3s,4r-3,4-bis benzoyloxy-3,4-dihydro-2h-pyran-2-yl methyl benzoate PubChem CID: 11134283 IUPAC Name: [(2R,3S,4R)-3,4-dibenzoyloxy-3,4-dihydro-2H-pyran-2-yl]methyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OCC2C(C(C=CO2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4
7-Fluorooxindole, 95%
CAS: 71294-03-6 Molecular Formula: C8H6FNO Molecular Weight (g/mol): 151.14 MDL Number: MFCD02179608 InChI Key: VMUIOEOYZHJLEZ-UHFFFAOYSA-N Synonym: 7-fluorooxindole,7-fluoroindolin-2-one,7-fluoro-oxindole,7-fluoro-2-oxindole,7-fluoroindolinone,7-fluoro-1,3-dihydro-2h-indol-2-one,2h-indol-2-one, 7-fluoro-1,3-dihydro,7-fluoro-1,3-dihydro-indol-2-one,7-fluoro-2,3-dihydro-1h-indol-2-one,1,3-dihydro-7-fluoro-2h-indol-2-one PubChem CID: 3734371 IUPAC Name: 7-fluoro-1,3-dihydroindol-2-one SMILES: C1C2=C(C(=CC=C2)F)NC1=O
n-Butyl levulinate, 98%
CAS: 2052-15-5 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.224 MDL Number: MFCD00009449 InChI Key: ISBWNEKJSSLXOD-UHFFFAOYSA-N Synonym: butyl levulinate,n-butyl levulinate,butyl laevulinate,pentanoic acid, 4-oxo-, butyl ester,n-butyl laevulinate,levulinic acid, butyl ester,butyl 4-ketovalerate,4-ketopentanoic acid butyl ester,butyl acetylpropionate,n-butyl 4-oxopentanoate PubChem CID: 16331 IUPAC Name: butyl 4-oxopentanoate SMILES: CCCCOC(=O)CCC(=O)C
3-(Tritylthio)propionic acid, 97%
CAS: 27144-18-9 Molecular Formula: C22H20O2S Molecular Weight (g/mol): 348.46 MDL Number: MFCD00237291 InChI Key: AECGEIVNZGQBJT-UHFFFAOYSA-N Synonym: 3-tritylthio propanoic acid,s-trityl-3-mercaptopropionic acid,3-tritylthio propionic acid,3-tritylsulfanylpropionic acid,3-triphenylmethyl sulfanyl propanoic acid,3-tritylsulfanyl-propionic acid,3-tritylmercapto propionic acid,s-trityl-beta-mercaptopropionic acid,propanoic acid, 3-triphenylmethyl thio,3-tritylsulfanyl propanoic acid PubChem CID: 262767 IUPAC Name: 3-tritylsulfanylpropanoic acid SMILES: OC(=O)CCSC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
4-Methylphenyl 2,3,4,6-tetra-O-acetyl-beta-D-thiogalactopyranoside, Thermo Scientific Chemicals
CAS: 28244-99-7 Molecular Formula: C21H26O9S Molecular Weight (g/mol): 454.49 MDL Number: MFCD09750783 InChI Key: XRFOIRMXQHXTRL-IFLJBQAJSA-N PubChem CID: 10366693 IUPAC Name: [(2R,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-(4-methylphenyl)sulfanyloxan-2-yl]methyl acetate SMILES: CC1=CC=C(C=C1)SC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
Ethyl imidazole-2-carboxylate, 97%
CAS: 33543-78-1 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.142 MDL Number: MFCD03426031 InChI Key: UHYNYIGCGVDBTC-UHFFFAOYSA-N Synonym: ethyl imidazole-2-carboxylate,1h-imidazole-2-carboxylic acid, ethyl ester,ethyl1h-imidazole-2-carboxylate,1h-imidazole-2-carboxylic acid ethyl ester,ethyl 2-imidazolecarboxylate,imidazole-2-carboxylic acid ethyl ester,2-ethoxycarbonyl-1h-imidazole,ethylimidazole-2-carboxylate,ethoxyformyl imidazole,zlchem 847 PubChem CID: 549404 IUPAC Name: ethyl 1H-imidazole-2-carboxylate SMILES: CCOC(=O)C1=NC=CN1