Organic acids and derivatives
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Diisobutyl Fumarate 98.0+%, TCI America™
CAS: 7283-69-4 Molecular Formula: C12H20O4 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00152430 InChI Key: RSRICHZMFPHXLE-AATRIKPKSA-N Synonym: Fumaric Acid Diisobutyl Ester PubChem CID: 5373437 IUPAC Name: 1,4-bis(2-methylpropyl) (2E)-but-2-enedioate SMILES: CC(C)COC(=O)\C=C\C(=O)OCC(C)C
| PubChem CID | 5373437 |
|---|---|
| CAS | 7283-69-4 |
| Molecular Weight (g/mol) | 228.29 |
| MDL Number | MFCD00152430 |
| SMILES | CC(C)COC(=O)\C=C\C(=O)OCC(C)C |
| Synonym | Fumaric Acid Diisobutyl Ester |
| IUPAC Name | 1,4-bis(2-methylpropyl) (2E)-but-2-enedioate |
| InChI Key | RSRICHZMFPHXLE-AATRIKPKSA-N |
| Molecular Formula | C12H20O4 |
1-(2,6-Dichlorophenyl)oxindole 98.0+%, TCI America™
CAS: 15362-40-0 Molecular Formula: C14H9Cl2NO Molecular Weight (g/mol): 278.13 MDL Number: MFCD00451393 InChI Key: JCICIFOYVSPMHG-UHFFFAOYSA-N Synonym: 1-(2,6-Dichlorophenyl)-2-oxoindoline, 1-(2,6-Dichlorophenyl)-2-indolinone, Diclofenac Amide PubChem CID: 27211 IUPAC Name: 1-(2,6-dichlorophenyl)-2,3-dihydro-1H-indol-2-one SMILES: ClC1=CC=CC(Cl)=C1N1C(=O)CC2=CC=CC=C12
| PubChem CID | 27211 |
|---|---|
| CAS | 15362-40-0 |
| Molecular Weight (g/mol) | 278.13 |
| MDL Number | MFCD00451393 |
| SMILES | ClC1=CC=CC(Cl)=C1N1C(=O)CC2=CC=CC=C12 |
| Synonym | 1-(2,6-Dichlorophenyl)-2-oxoindoline, 1-(2,6-Dichlorophenyl)-2-indolinone, Diclofenac Amide |
| IUPAC Name | 1-(2,6-dichlorophenyl)-2,3-dihydro-1H-indol-2-one |
| InChI Key | JCICIFOYVSPMHG-UHFFFAOYSA-N |
| Molecular Formula | C14H9Cl2NO |
o-Tolylacetic Acid 98.0+%, TCI America™
CAS: 644-36-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00004328 InChI Key: RZWGTXHSYZGXKF-UHFFFAOYSA-N Synonym: o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid PubChem CID: 69519 IUPAC Name: 2-(2-methylphenyl)acetic acid SMILES: CC1=CC=CC=C1CC(=O)O
| PubChem CID | 69519 |
|---|---|
| CAS | 644-36-0 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00004328 |
| SMILES | CC1=CC=CC=C1CC(=O)O |
| Synonym | o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid |
| IUPAC Name | 2-(2-methylphenyl)acetic acid |
| InChI Key | RZWGTXHSYZGXKF-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
2-Cyanophenylboronic Acid 1,3-Propanediol Ester 97.0+%, TCI America™
CAS: 172732-52-4 Molecular Formula: C10H10BNO2 Molecular Weight (g/mol): 187.005 MDL Number: MFCD04039012 InChI Key: REQZFVYFYAZUMG-UHFFFAOYSA-N Synonym: 2-1,3,2-dioxaborinan-2-yl benzonitrile,2-cyanophenylboronic acid 1,3-propanediol ester,2-2-cyanophenyl-1,3,2-dioxaborinane,2-cyanobenzeneboronic acid 1,3-propanediol ester,2-cyanophenylboronic acid propanediol ester,2-cyanophenylboronic acid, 1,3-propanediol cyclic ester,2-1,3,2-dioxaborinane-2-yl benzonitrile,2-1,3,2-dioxaborinan-2-yl-benzonitrile,benzonitrile, 2-1,3,2-dioxaborinan-2-yl,2-cyanophenylboronic acid,1,3-propanediol PubChem CID: 3529602 IUPAC Name: 2-(1,3,2-dioxaborinan-2-yl)benzonitrile SMILES: B1(OCCCO1)C2=CC=CC=C2C#N
| PubChem CID | 3529602 |
|---|---|
| CAS | 172732-52-4 |
| Molecular Weight (g/mol) | 187.005 |
| MDL Number | MFCD04039012 |
| SMILES | B1(OCCCO1)C2=CC=CC=C2C#N |
| Synonym | 2-1,3,2-dioxaborinan-2-yl benzonitrile,2-cyanophenylboronic acid 1,3-propanediol ester,2-2-cyanophenyl-1,3,2-dioxaborinane,2-cyanobenzeneboronic acid 1,3-propanediol ester,2-cyanophenylboronic acid propanediol ester,2-cyanophenylboronic acid, 1,3-propanediol cyclic ester,2-1,3,2-dioxaborinane-2-yl benzonitrile,2-1,3,2-dioxaborinan-2-yl-benzonitrile,benzonitrile, 2-1,3,2-dioxaborinan-2-yl,2-cyanophenylboronic acid,1,3-propanediol |
| IUPAC Name | 2-(1,3,2-dioxaborinan-2-yl)benzonitrile |
| InChI Key | REQZFVYFYAZUMG-UHFFFAOYSA-N |
| Molecular Formula | C10H10BNO2 |
(1alpha,2alpha,4alpha)-1,2,4-Cyclohexanetricarboxylic Acid 98.0+%, TCI America™
CAS: 76784-95-7 Molecular Formula: C9H12O6 Molecular Weight (g/mol): 216.189 InChI Key: WTNDADANUZETTI-NGJCXOISSA-N PubChem CID: 12616203 IUPAC Name: (1S,2R,4R)-cyclohexane-1,2,4-tricarboxylic acid SMILES: C1CC(C(CC1C(=O)O)C(=O)O)C(=O)O
| PubChem CID | 12616203 |
|---|---|
| CAS | 76784-95-7 |
| Molecular Weight (g/mol) | 216.189 |
| SMILES | C1CC(C(CC1C(=O)O)C(=O)O)C(=O)O |
| IUPAC Name | (1S,2R,4R)-cyclohexane-1,2,4-tricarboxylic acid |
| InChI Key | WTNDADANUZETTI-NGJCXOISSA-N |
| Molecular Formula | C9H12O6 |
Direct Yellow 8, TCI America™
CAS: 10130-29-7 Molecular Formula: C24H19N4NaO5S2 Molecular Weight (g/mol): 530.55 MDL Number: MFCD00005779 InChI Key: OZRXNTRXLHTVPI-UHFFFAOYSA-M Synonym: Acid Yellow 186, Coomassie Yellow 6G, Direct Pure Yellow 5G PubChem CID: 23668793 IUPAC Name: sodium 6-methyl-2-(4-{2-[2-oxo-1-(phenylcarbamoyl)propylidene]hydrazin-1-yl}phenyl)-1,3-benzothiazole-7-sulfonate SMILES: [Na+].CC(=O)C(=NNC1=CC=C(C=C1)C1=NC2=CC=C(C)C(=C2S1)S([O-])(=O)=O)C(=O)NC1=CC=CC=C1
| PubChem CID | 23668793 |
|---|---|
| CAS | 10130-29-7 |
| Molecular Weight (g/mol) | 530.55 |
| MDL Number | MFCD00005779 |
| SMILES | [Na+].CC(=O)C(=NNC1=CC=C(C=C1)C1=NC2=CC=C(C)C(=C2S1)S([O-])(=O)=O)C(=O)NC1=CC=CC=C1 |
| Synonym | Acid Yellow 186, Coomassie Yellow 6G, Direct Pure Yellow 5G |
| IUPAC Name | sodium 6-methyl-2-(4-{2-[2-oxo-1-(phenylcarbamoyl)propylidene]hydrazin-1-yl}phenyl)-1,3-benzothiazole-7-sulfonate |
| InChI Key | OZRXNTRXLHTVPI-UHFFFAOYSA-M |
| Molecular Formula | C24H19N4NaO5S2 |
Isobutyl Isobutyrate 98.0+%, TCI America™
CAS: 97-85-8 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00008916 InChI Key: RXGUIWHIADMCFC-UHFFFAOYSA-N Synonym: isobutyl isobutyrate,isobutyl 2-methylpropanoate,isobutyl isobutanoate,isobutyric acid, isobutyl ester,propanoic acid, 2-methyl-, 2-methylpropyl ester,2-methylpropyl 2-methylpropionate,2-methylpropyl isobutyrate,isobutylester kyseliny isomaselne,fema number 2189,2-methyl-1-propyl 2-methylpropanoate PubChem CID: 7351 IUPAC Name: 2-methylpropyl 2-methylpropanoate SMILES: CC(C)COC(=O)C(C)C
| PubChem CID | 7351 |
|---|---|
| CAS | 97-85-8 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00008916 |
| SMILES | CC(C)COC(=O)C(C)C |
| Synonym | isobutyl isobutyrate,isobutyl 2-methylpropanoate,isobutyl isobutanoate,isobutyric acid, isobutyl ester,propanoic acid, 2-methyl-, 2-methylpropyl ester,2-methylpropyl 2-methylpropionate,2-methylpropyl isobutyrate,isobutylester kyseliny isomaselne,fema number 2189,2-methyl-1-propyl 2-methylpropanoate |
| IUPAC Name | 2-methylpropyl 2-methylpropanoate |
| InChI Key | RXGUIWHIADMCFC-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
2,2,3,4,4,4-Hexafluorobutyl Methacrylate (stabilized with MEHQ) 98.0+%, TCI America™
CAS: 36405-47-7 Molecular Formula: C8H8F6O2 Molecular Weight (g/mol): 250.14 MDL Number: MFCD00042311 InChI Key: DFVPUWGVOPDJTC-UHFFFAOYSA-N Synonym: 2,2,3,4,4,4-hexafluorobutyl methacrylate,1h,1h,3h-hexafluorobutyl methacrylate,hexafluorobutyl methacrylate,methacrylic acid 2,2,3,4,4,4-hexafluorobutyl ester,2-propenoic acid, 2-methyl-, 2,2,3,4,4,4-hexafluorobutyl ester,hexafluorobutyl methacrylate polymer,hfbma,acmc-1adv6,ksc489s1j,2-propenoic acid, 2-methyl-, 2,2,3,4,4,4-hexafluorobutyl ester, homopolymer PubChem CID: 549772 IUPAC Name: 2,2,3,4,4,4-hexafluorobutyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC(C(C(F)(F)F)F)(F)F
| PubChem CID | 549772 |
|---|---|
| CAS | 36405-47-7 |
| Molecular Weight (g/mol) | 250.14 |
| MDL Number | MFCD00042311 |
| SMILES | CC(=C)C(=O)OCC(C(C(F)(F)F)F)(F)F |
| Synonym | 2,2,3,4,4,4-hexafluorobutyl methacrylate,1h,1h,3h-hexafluorobutyl methacrylate,hexafluorobutyl methacrylate,methacrylic acid 2,2,3,4,4,4-hexafluorobutyl ester,2-propenoic acid, 2-methyl-, 2,2,3,4,4,4-hexafluorobutyl ester,hexafluorobutyl methacrylate polymer,hfbma,acmc-1adv6,ksc489s1j,2-propenoic acid, 2-methyl-, 2,2,3,4,4,4-hexafluorobutyl ester, homopolymer |
| IUPAC Name | 2,2,3,4,4,4-hexafluorobutyl 2-methylprop-2-enoate |
| InChI Key | DFVPUWGVOPDJTC-UHFFFAOYSA-N |
| Molecular Formula | C8H8F6O2 |
3-Benzalbutyramide 98.0+%, TCI America™
CAS: 7236-47-7 Molecular Formula: C11H13NO Molecular Weight (g/mol): 175.23 MDL Number: MFCD00059860 InChI Key: KAJZGRFYZKWYDX-VQHVLOKHSA-N Synonym: 3-Benzylidenebutyramide PubChem CID: 5371849 IUPAC Name: (3E)-3-methyl-4-phenylbut-3-enamide SMILES: C\C(CC(N)=O)=C/C1=CC=CC=C1
| PubChem CID | 5371849 |
|---|---|
| CAS | 7236-47-7 |
| Molecular Weight (g/mol) | 175.23 |
| MDL Number | MFCD00059860 |
| SMILES | C\C(CC(N)=O)=C/C1=CC=CC=C1 |
| Synonym | 3-Benzylidenebutyramide |
| IUPAC Name | (3E)-3-methyl-4-phenylbut-3-enamide |
| InChI Key | KAJZGRFYZKWYDX-VQHVLOKHSA-N |
| Molecular Formula | C11H13NO |
Ethyl 4,4,4-Trifluoro-3-hydroxybutyrate 98.0+%, TCI America™
CAS: 372-30-5 Molecular Formula: C6H9F3O3 Molecular Weight (g/mol): 186.13 MDL Number: MFCD00040842 InChI Key: ZWEDFBKLJILTMC-UHFFFAOYNA-N Synonym: ethyl 3-hydroxy-4,4,4-trifluorobutyrate,ethyl 4,4,4-trifluoro-3-hydroxybutyrate,ethyl 3-hydroxy-4,4,4-trifluorobutanoate,3-hydroxy-4,4,4-trifluorobutyric acid ethyl ester,4,4,4-trifluoro-3-hydroxybutyric acid ethyl ester,ethyl3-hydroxy-4,4,4-trifluorobutyrate,butanoic acid, 4,4,4-trifluoro-3-hydroxy-, ethyl ester,acmc-209irs,acmc-20al28,ksc496k8b PubChem CID: 136210 IUPAC Name: ethyl 4,4,4-trifluoro-3-hydroxybutanoate SMILES: CCOC(=O)CC(O)C(F)(F)F
| PubChem CID | 136210 |
|---|---|
| CAS | 372-30-5 |
| Molecular Weight (g/mol) | 186.13 |
| MDL Number | MFCD00040842 |
| SMILES | CCOC(=O)CC(O)C(F)(F)F |
| Synonym | ethyl 3-hydroxy-4,4,4-trifluorobutyrate,ethyl 4,4,4-trifluoro-3-hydroxybutyrate,ethyl 3-hydroxy-4,4,4-trifluorobutanoate,3-hydroxy-4,4,4-trifluorobutyric acid ethyl ester,4,4,4-trifluoro-3-hydroxybutyric acid ethyl ester,ethyl3-hydroxy-4,4,4-trifluorobutyrate,butanoic acid, 4,4,4-trifluoro-3-hydroxy-, ethyl ester,acmc-209irs,acmc-20al28,ksc496k8b |
| IUPAC Name | ethyl 4,4,4-trifluoro-3-hydroxybutanoate |
| InChI Key | ZWEDFBKLJILTMC-UHFFFAOYNA-N |
| Molecular Formula | C6H9F3O3 |
Vinyl Crotonate (stabilized with MEHQ) 99.0+%, TCI America™
CAS: 14861-06-4 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00009288 InChI Key: IYNRVIKPUTZSOR-HWKANZROSA-N Synonym: vinyl crotonate,vinyl 2-butenoate,crotonic acid, vinyl ester,crotonic acid vinyl ester,unii-smc9a01nvs,ethenyl e-but-2-enoate,vinylester kyseliny krotonove,vinyl but-2-enoate,smc9a01nvs,vinylester kyseliny krotonove czech PubChem CID: 5365800 IUPAC Name: ethenyl (E)-but-2-enoate SMILES: CC=CC(=O)OC=C
| PubChem CID | 5365800 |
|---|---|
| CAS | 14861-06-4 |
| Molecular Weight (g/mol) | 112.128 |
| MDL Number | MFCD00009288 |
| SMILES | CC=CC(=O)OC=C |
| Synonym | vinyl crotonate,vinyl 2-butenoate,crotonic acid, vinyl ester,crotonic acid vinyl ester,unii-smc9a01nvs,ethenyl e-but-2-enoate,vinylester kyseliny krotonove,vinyl but-2-enoate,smc9a01nvs,vinylester kyseliny krotonove czech |
| IUPAC Name | ethenyl (E)-but-2-enoate |
| InChI Key | IYNRVIKPUTZSOR-HWKANZROSA-N |
| Molecular Formula | C6H8O2 |
Bis(phenylacetyl) Disulfide 98.0+%, TCI America™
CAS: 15088-78-5 Molecular Formula: C16H14O2S2 Molecular Weight (g/mol): 302.41 MDL Number: MFCD00513572 InChI Key: IXGZXXBJSZISOO-UHFFFAOYSA-N Synonym: phenylacetyl disulfide,2-phenylacetic dithioperoxyanhydride,phenylacetyl disulphide,bis phenylacetyl disulfide,bis phenylacetyl disulphide,2-phenyl-1-2-phenylacetyl disulfanyl ethanone,bis phenylacetyl persulfide,phenylacetyl disulfide 5g,s-2-phenylacetyl sulfanyl 2-phenylethanethioate PubChem CID: 3378603 IUPAC Name: 2-phenyl-1-[(2-phenylacetyl)disulfanyl]ethan-1-one SMILES: O=C(CC1=CC=CC=C1)SSC(=O)CC1=CC=CC=C1
| PubChem CID | 3378603 |
|---|---|
| CAS | 15088-78-5 |
| Molecular Weight (g/mol) | 302.41 |
| MDL Number | MFCD00513572 |
| SMILES | O=C(CC1=CC=CC=C1)SSC(=O)CC1=CC=CC=C1 |
| Synonym | phenylacetyl disulfide,2-phenylacetic dithioperoxyanhydride,phenylacetyl disulphide,bis phenylacetyl disulfide,bis phenylacetyl disulphide,2-phenyl-1-2-phenylacetyl disulfanyl ethanone,bis phenylacetyl persulfide,phenylacetyl disulfide 5g,s-2-phenylacetyl sulfanyl 2-phenylethanethioate |
| IUPAC Name | 2-phenyl-1-[(2-phenylacetyl)disulfanyl]ethan-1-one |
| InChI Key | IXGZXXBJSZISOO-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2S2 |
Sodium 2-Bromoethanesulfonate 97.0+%, TCI America™
CAS: 4263-52-9 Molecular Formula: C2H4BrNaO3S Molecular Weight (g/mol): 211.005 MDL Number: MFCD00007530 InChI Key: HNFOAHXBHLWKNF-UHFFFAOYSA-M Synonym: sodium 2-bromoethanesulfonate,2-bromoethanesulfonic acid sodium salt,sodium 2-bromoethanesulphonate,2-bromoethanesulfonic acid, sodium salt,sodium bromoethylsulfonate,ethanesulfonic acid, 2-bromo-, sodium salt,ethanesulfonic acid, 2-bromo-, sodium salt 1:1,sodium 2-bromoethane sulfonate,2-bromoethanesulfonic acid sodium,natrium-2-bromethansulfonat PubChem CID: 23666797 IUPAC Name: sodium;2-bromoethanesulfonate SMILES: C(CBr)S(=O)(=O)[O-].[Na+]
| PubChem CID | 23666797 |
|---|---|
| CAS | 4263-52-9 |
| Molecular Weight (g/mol) | 211.005 |
| MDL Number | MFCD00007530 |
| SMILES | C(CBr)S(=O)(=O)[O-].[Na+] |
| Synonym | sodium 2-bromoethanesulfonate,2-bromoethanesulfonic acid sodium salt,sodium 2-bromoethanesulphonate,2-bromoethanesulfonic acid, sodium salt,sodium bromoethylsulfonate,ethanesulfonic acid, 2-bromo-, sodium salt,ethanesulfonic acid, 2-bromo-, sodium salt 1:1,sodium 2-bromoethane sulfonate,2-bromoethanesulfonic acid sodium,natrium-2-bromethansulfonat |
| IUPAC Name | sodium;2-bromoethanesulfonate |
| InChI Key | HNFOAHXBHLWKNF-UHFFFAOYSA-M |
| Molecular Formula | C2H4BrNaO3S |
n-Octanamide 98.0+%, TCI America™
CAS: 629-01-6 Molecular Formula: C8H17NO Molecular Weight (g/mol): 143.23 MDL Number: MFCD00191675 InChI Key: LTHCSWBWNVGEFE-UHFFFAOYSA-N PubChem CID: 69414 IUPAC Name: octanamide SMILES: CCCCCCCC(=O)N
| PubChem CID | 69414 |
|---|---|
| CAS | 629-01-6 |
| Molecular Weight (g/mol) | 143.23 |
| MDL Number | MFCD00191675 |
| SMILES | CCCCCCCC(=O)N |
| IUPAC Name | octanamide |
| InChI Key | LTHCSWBWNVGEFE-UHFFFAOYSA-N |
| Molecular Formula | C8H17NO |
Ethyl 2-(Hydroxymethyl)acrylate (stabilized with HQ) 95.0+%, TCI America™
CAS: 10029-04-6 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.14 MDL Number: MFCD01673859 InChI Key: SYGAXBISYRORDR-UHFFFAOYSA-N Synonym: 2-(Hydroxymethyl)acrylic Acid Ethyl Ester PubChem CID: 24827 IUPAC Name: ethyl 2-(hydroxymethyl)prop-2-enoate SMILES: CCOC(=O)C(=C)CO
| PubChem CID | 24827 |
|---|---|
| CAS | 10029-04-6 |
| Molecular Weight (g/mol) | 130.14 |
| MDL Number | MFCD01673859 |
| SMILES | CCOC(=O)C(=C)CO |
| Synonym | 2-(Hydroxymethyl)acrylic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-(hydroxymethyl)prop-2-enoate |
| InChI Key | SYGAXBISYRORDR-UHFFFAOYSA-N |
| Molecular Formula | C6H10O3 |