Organic acids and derivatives
Thermo Scientific Chemicals Cefditoren pivoxyl
CAS: 117467-28-4 Molecular Formula: C25H28N6O7S3 Molecular Weight (g/mol): 620.71 MDL Number: MFCD00933166 InChI Key: AFZFFLVORLEPPO-UHFFFAOYNA-N IUPAC Name: {7-[2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyloxy}methyl 2,2-dimethylpropanoate SMILES: CON=C(C(=O)NC1C2SCC(C=CC3=C(C)N=CS3)=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)C1=CSC(N)=N1
Triethyl 2-phosphonopentanoate, 98%
CAS: 35051-49-1 Molecular Formula: C11H23O5P Molecular Weight (g/mol): 266.274 MDL Number: MFCD00015163 InChI Key: BUPVIVDUPRDDFI-UHFFFAOYSA-N Synonym: triethyl 2-phosphonopentanoate,ethyl 2-diethoxyphosphoryl pentanoate,pentanoic acid, 2-diethoxyphosphinyl-, ethyl ester,valeric acid, 2-diethylphosphono-, ethyl ester,alpha-carbethoxybutylphosphonic acid, diethyl ester,triethyl 2-phosphonovalerate,phosphonic acid, alpha-carbethoxybutyl-, diethyl ester,ethyl 2-diethoxyphosphoryl pentanoate #,diethyl 1-ethoxycarbonyl butylphosphonate PubChem CID: 98244 IUPAC Name: ethyl 2-diethoxyphosphorylpentanoate SMILES: CCCC(C(=O)OCC)P(=O)(OCC)OCC
2-Ethylhexyl methacrylate, 99%, stabilized
CAS: 688-84-6 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.31 MDL Number: MFCD00009494 InChI Key: WDQMWEYDKDCEHT-UHFFFAOYSA-N Synonym: 2-ethylhexyl methacrylate,2-ethyl-1-hexyl methacrylate,2-ethylhexyl methacryate,2-propenoic acid, 2-methyl-, 2-ethylhexyl ester,methacrylic acid 2-ethylhexyl ester,methacrylic acid, 2-ethylhexyl ester,methacrylate, 2-ethylisohexy,2-ethylhexylmethacrylate,dsstox_cid_7293,dsstox_rid_78391 PubChem CID: 12713 IUPAC Name: 2-ethylhexyl 2-methylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(=C)C
3-Nitrobenzamide, 98%
CAS: 645-09-0 Molecular Formula: C7H6N2O3 Molecular Weight (g/mol): 166.14 MDL Number: MFCD00007984 InChI Key: KWAYEPXDGHYGRW-UHFFFAOYSA-N Synonym: m-nitrobenzamide,benzamide, 3-nitro,benzamide, m-nitro,3-nitro-benzamide,3-nitrophenylcarboxamide,acmc-209nmr,3-nitrobenzamide,dsstox_cid_5732,dsstox_rid_77897,dsstox_gsid_25732 PubChem CID: 12576 IUPAC Name: 3-nitrobenzamide SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N
3,4,5-Trimethoxybenzeneboronic acid, 98%
CAS: 182163-96-8 Molecular Formula: C9H13BO5 Molecular Weight (g/mol): 212.008 MDL Number: MFCD01075676 InChI Key: RULQUTYJXDLRFL-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxybenzeneboronic acid,3,4,5-trimethoxyphenyl boronic acid,3,4,5-trimethoxyphenyl boranediol,3,4,5-trimethoxylphenylboronic acid,boronic acid, 3,4,5-trimethoxyphenyl,pubchem7894,acmc-1c5iu,ksc174i9j,3,4,5-trimethoxy phenylboronic acid PubChem CID: 2734390 IUPAC Name: (3,4,5-trimethoxyphenyl)boronic acid SMILES: B(C1=CC(=C(C(=C1)OC)OC)OC)(O)O
Cyclohexyl p-toluenesulfonate, 97%
CAS: 953-91-3 Molecular Formula: C13H18O3S Molecular Weight (g/mol): 254.344 MDL Number: MFCD00014291 InChI Key: OHHPZPDQZMUTCA-UHFFFAOYSA-N Synonym: cyclohexyl p-toluenesulfonate,cyclohexyl tosylate,cyclohexyl toluenesulfonate,cyclohexylp-toluenesulfonate,cyclohexyl p-toluenesulphonate,benzenesulfonic acid, 4-methyl-, cyclohexyl ester,p-toluenesulfonic acid, cyclohexyl ester,cyclohexyl-p-toluene sulfonate,benzenesulfonic acid, cyclohexyl ester,acmc-20aj06 PubChem CID: 13722 IUPAC Name: cyclohexyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2
N-(Hydroxymethyl)phthalimide, 97%
CAS: 118-29-6 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.16 MDL Number: MFCD00005899 InChI Key: MNSGOOCAMMSKGI-UHFFFAOYSA-N Synonym: n-hydroxymethyl phthalimide,n-hydroxymethylphthalimide,2-hydroxymethyl isoindoline-1,3-dione,phthalimidomethanol,phthalimidomethyl alcohol,n-methylolphthalimide,oxymethyl phthalimide,1h-isoindole-1,3 2h-dione, 2-hydroxymethyl,hydroxymethylphthalimide,methanol, phthalimido PubChem CID: 8354 ChEBI: CHEBI:38816 IUPAC Name: 2-(hydroxymethyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CO
Methyl 3,4-diaminobenzoate, 98%
CAS: 36692-49-6 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017098 InChI Key: IOPLHGOSNCJOOO-UHFFFAOYSA-N Synonym: 3,4-diaminobenzoic acid methyl ester,methyl3,4-diaminobenzoate,methyl-3,4-diaminobenzoate,benzoic acid, 3,4-diamino-, methyl ester,3,4-diamino-benzoic acid methyl ester,methyl 3,4-diaminobenzenecarboxylate,pubchem4610,acmc-1bn7s,methyl 3,4-diamino-benzoate,methyl-3,4-diamino-benzoate PubChem CID: 135524 IUPAC Name: methyl 3,4-diaminobenzoate SMILES: COC(=O)C1=CC=C(N)C(N)=C1
beta-D-Ribofuranose 1,2,3,5-tetraacetate, 98+%
CAS: 13035-61-5 Molecular Formula: C13H18O9 Molecular Weight (g/mol): 318.278 MDL Number: MFCD00005358 InChI Key: IHNHAHWGVLXCCI-FDYHWXHSSA-N Synonym: beta-d-ribofuranose 1,2,3,5-tetraacetate,tetra-o-acetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose,tetraacetylribose,1,2,3,5-tetraacetyl-.-d-ribofuranose,tetra-o-acetyl-b-d-ribofuranose,1,2,3,5-tetraacetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-b-d-ribofuranose,.beta.-d-ribofuranose, tetraacetate,ribofuranose, tetraacetate, .beta.-d PubChem CID: 83064 IUPAC Name: [(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C
2-Bromo-3-fluoropropionic acid, 96%, Thermo Scientific Chemicals
CAS: 16652-36-1 Molecular Formula: C3H4BrFO2 Molecular Weight (g/mol): 170.97 MDL Number: MFCD09800640 InChI Key: FBPUCVAAEPPEMG-UHFFFAOYNA-N Synonym: 2-bromo-3-fluoropropionic acid,acmc-20ao2z,3-fluoro-2-bromo-propionic acid PubChem CID: 316511 IUPAC Name: 2-bromo-3-fluoropropanoic acid SMILES: OC(=O)C(Br)CF
1,3-Dimethylimidazolium dimethyl phosphate, 98%
CAS: 654058-04-5 Molecular Formula: C7H15N2O4P Molecular Weight (g/mol): 222.181 MDL Number: MFCD08275369 InChI Key: GSGLHYXFTXGIAQ-UHFFFAOYSA-M Synonym: 1,3-dimethylimidazolium dimethyl phosphate,acmc-1b6nn,1,3-dimethylimidazoliumdimethylphosphate,dsstox_cid_27946,dsstox_rid_82698,dsstox_gsid_47970,1-methyl-3-methylimidazolium dimethylphosphate,1,3-dimethyl-imidazolium dimethylphosphate,1,3-dimethylimidazolium dimethyl phosphate hplc PubChem CID: 16069365 IUPAC Name: 1,3-dimethylimidazol-1-ium;dimethyl phosphate SMILES: CN1C=C[N+](=C1)C.COP(=O)([O-])OC
Propargyl p-toluenesulfonate, 97%
CAS: 6165-76-0 Molecular Formula: C10H10O3S Molecular Weight (g/mol): 210.25 MDL Number: MFCD01462194 InChI Key: LMBVCSFXFFROTA-UHFFFAOYSA-N Synonym: propargyl p-toluenesulfonate,propargyl tosylate,prop-2-yn-1-yl 4-methylbenzenesulfonate,p-toluenesulfonic acid, 2-propynyl ester,2-propyn-1-ol, 4-methylbenzenesulfonate,ccris 9146,p-toluenesulfonic acid propargyl ester,propargylp-toluenesulfonate,propargyl p-toluene sulfonate,acmc-209mv7 PubChem CID: 22547 IUPAC Name: prop-2-ynyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC#C
1-Acetyl-5-bromoindoline, 98%
CAS: 22190-38-1 Molecular Formula: C10H10BrNO Molecular Weight (g/mol): 240.1 MDL Number: MFCD00056017 InChI Key: WQKQAIXOTCPWFE-UHFFFAOYSA-N Synonym: 1-acetyl-5-bromoindoline,1-5-bromoindolin-1-yl ethanone,1-5-bromo-2,3-dihydro-1h-indol-1-yl ethan-1-one,1-5-bromo-2,3-dihydroindol-1-yl ethanone,1-5-bromo-2,3-dihydro-1h-indol-1-yl ethanone,1h-indole, 1-acetyl-5-bromo-2,3-dihydro,1-acetyl-5-bromo-2,3-dihydroindole,acmc-20ailu,5-bromo-n-acetylindoline,maybridge1_005011 PubChem CID: 721847 IUPAC Name: 1-(5-bromo-2,3-dihydroindol-1-yl)ethanone SMILES: CC(=O)N1CCC2=C1C=CC(=C2)Br
Dibenzyl phosphate, 98%
CAS: 1623-08-1 Molecular Formula: C14H15O4P Molecular Weight (g/mol): 278.244 MDL Number: MFCD00004775 InChI Key: HDFFVHSMHLDSLO-UHFFFAOYSA-N Synonym: dibenzyl phosphate,phosphoric acid dibenzyl ester,dibenzylphosphoric acid,unii-y65r35lz0s,phosphoric acid, bis phenylmethyl ester,dibenzylphosphate,creatine phosphate disodium impurity 4,dibenzyloxyphosphinic acid,dibenzyl-phosphate,pubchem14883 PubChem CID: 74189 IUPAC Name: dibenzyl hydrogen phosphate SMILES: C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2
Cycloheptanecarboxylic acid, 95%
CAS: 1460-16-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00004152 InChI Key: VZFUCHSFHOYXIS-UHFFFAOYSA-N Synonym: cycloheptane carboxylic acid,cycloheptanoic acid,cycloheptanecarboxylicacid,cyclohepatan carboxylic acid,acmc-1c1rc,sampl4, o9,vzfuchsfhoyxis-uhfffaoysa,cycloheptanecarboxylic acid PubChem CID: 15091 ChEBI: CHEBI:29564 IUPAC Name: cycloheptanecarboxylic acid SMILES: OC(=O)C1CCCCCC1