Organic acids and derivatives
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Cyclopentylacetic Acid 98.0+%, TCI America™
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
| PubChem CID | 71606 |
|---|---|
| CAS | 1123-00-8 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00001387 |
| SMILES | OC(=O)CC1CCCC1 |
| Synonym | cyclopentylacetic acid,cyclopentaneacetic acid,cycylopentylacetic acid,carboxymethyl cyclopentane,cyclopentyl acetic acid,cyclopentyacetic acid,cyclopentanacetic acid,cyclopentyl-acetic acid,2-cyclopentylaceticacid,cyclopentane acetic acid |
| IUPAC Name | 2-cyclopentylacetic acid |
| InChI Key | YVHAIVPPUIZFBA-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
Dimethyl Citraconate 99.0+%, TCI America™
CAS: 617-54-9 Molecular Formula: C7H10O4 Molecular Weight (g/mol): 158.15 MDL Number: MFCD00059306 InChI Key: WQEXBUQDXKPVHR-SNAWJCMRSA-N Synonym: Citraconic Acid Dimethyl Ester PubChem CID: 5355715 IUPAC Name: 1,4-dimethyl (2E)-2-methylbut-2-enedioate SMILES: COC(=O)\C=C(/C)C(=O)OC
| PubChem CID | 5355715 |
|---|---|
| CAS | 617-54-9 |
| Molecular Weight (g/mol) | 158.15 |
| MDL Number | MFCD00059306 |
| SMILES | COC(=O)\C=C(/C)C(=O)OC |
| Synonym | Citraconic Acid Dimethyl Ester |
| IUPAC Name | 1,4-dimethyl (2E)-2-methylbut-2-enedioate |
| InChI Key | WQEXBUQDXKPVHR-SNAWJCMRSA-N |
| Molecular Formula | C7H10O4 |
Ethyl Cyclohexylacetate 98.0+%, TCI America™
CAS: 5452-75-5 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00001517 InChI Key: ZBDAMDWKXGTKBT-UHFFFAOYSA-N Synonym: ethyl cyclohexylacetate,ethyl cyclohexaneacetate,cyclohexaneacetic acid, ethyl ester,ethyl-2-cyclohexylacetate,ethylcyclohexylacetate,unii-v36o028g9r,cyclohexylacetic acid ethyl ester,cyclohexaneacetic acid ethyl ester,cyclohexyl acetic acid ethyl ester,pubchem20245 PubChem CID: 21595 IUPAC Name: ethyl 2-cyclohexylacetate SMILES: CCOC(=O)CC1CCCCC1
| PubChem CID | 21595 |
|---|---|
| CAS | 5452-75-5 |
| Molecular Weight (g/mol) | 170.25 |
| MDL Number | MFCD00001517 |
| SMILES | CCOC(=O)CC1CCCCC1 |
| Synonym | ethyl cyclohexylacetate,ethyl cyclohexaneacetate,cyclohexaneacetic acid, ethyl ester,ethyl-2-cyclohexylacetate,ethylcyclohexylacetate,unii-v36o028g9r,cyclohexylacetic acid ethyl ester,cyclohexaneacetic acid ethyl ester,cyclohexyl acetic acid ethyl ester,pubchem20245 |
| IUPAC Name | ethyl 2-cyclohexylacetate |
| InChI Key | ZBDAMDWKXGTKBT-UHFFFAOYSA-N |
| Molecular Formula | C10H18O2 |
Triallyl Citrate 90.0+%, TCI America™
CAS: 6299-73-6 Molecular Formula: C15H20O7 Molecular Weight (g/mol): 312.318 MDL Number: MFCD00059327 InChI Key: PLCFYBDYBCOLSP-UHFFFAOYSA-N Synonym: Citric Acid Triallyl Ester PubChem CID: 80534 IUPAC Name: tris(prop-2-enyl) 2-hydroxypropane-1,2,3-tricarboxylate SMILES: C=CCOC(=O)CC(CC(=O)OCC=C)(C(=O)OCC=C)O
| PubChem CID | 80534 |
|---|---|
| CAS | 6299-73-6 |
| Molecular Weight (g/mol) | 312.318 |
| MDL Number | MFCD00059327 |
| SMILES | C=CCOC(=O)CC(CC(=O)OCC=C)(C(=O)OCC=C)O |
| Synonym | Citric Acid Triallyl Ester |
| IUPAC Name | tris(prop-2-enyl) 2-hydroxypropane-1,2,3-tricarboxylate |
| InChI Key | PLCFYBDYBCOLSP-UHFFFAOYSA-N |
| Molecular Formula | C15H20O7 |
3-Chloro-2,2,3,3-tetrafluoropropionic Acid 98.0+%, TCI America™
CAS: 661-82-5 Molecular Formula: C3HClF4O2 Molecular Weight (g/mol): 180.483 MDL Number: MFCD00153099 InChI Key: XJRMCFMZGRJXEZ-UHFFFAOYSA-N PubChem CID: 2782491 IUPAC Name: 3-chloro-2,2,3,3-tetrafluoropropanoic acid SMILES: C(=O)(C(C(F)(F)Cl)(F)F)O
| PubChem CID | 2782491 |
|---|---|
| CAS | 661-82-5 |
| Molecular Weight (g/mol) | 180.483 |
| MDL Number | MFCD00153099 |
| SMILES | C(=O)(C(C(F)(F)Cl)(F)F)O |
| IUPAC Name | 3-chloro-2,2,3,3-tetrafluoropropanoic acid |
| InChI Key | XJRMCFMZGRJXEZ-UHFFFAOYSA-N |
| Molecular Formula | C3HClF4O2 |
Hydroxypropyl Acrylate (mixture of 2-Hydroxypropyl and 2-Hydroxy-1-methylethyl Acrylate) 90.0+%, TCI America™
CAS: 25584-83-2 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD04113589 InChI Key: QZPSOSOOLFHYRR-UHFFFAOYSA-N Synonym: Acrylic Acid Hydroxypropyl Ester, Propylene Glycol Monoacrylate PubChem CID: 33101 IUPAC Name: 3-hydroxypropyl prop-2-enoate SMILES: C=CC(=O)OCCCO
| PubChem CID | 33101 |
|---|---|
| CAS | 25584-83-2 |
| Molecular Weight (g/mol) | 130.143 |
| MDL Number | MFCD04113589 |
| SMILES | C=CC(=O)OCCCO |
| Synonym | Acrylic Acid Hydroxypropyl Ester, Propylene Glycol Monoacrylate |
| IUPAC Name | 3-hydroxypropyl prop-2-enoate |
| InChI Key | QZPSOSOOLFHYRR-UHFFFAOYSA-N |
| Molecular Formula | C6H10O3 |
5-Amino-2-benzimidazolinone 98.0+%, TCI America™
CAS: 95-23-8 Molecular Formula: C7H7N3O Molecular Weight (g/mol): 149.153 MDL Number: MFCD00053555 InChI Key: BCXSVFBDMPSKPT-UHFFFAOYSA-N PubChem CID: 66765 IUPAC Name: 5-amino-1,3-dihydrobenzimidazol-2-one SMILES: C1=CC2=C(C=C1N)NC(=O)N2
| PubChem CID | 66765 |
|---|---|
| CAS | 95-23-8 |
| Molecular Weight (g/mol) | 149.153 |
| MDL Number | MFCD00053555 |
| SMILES | C1=CC2=C(C=C1N)NC(=O)N2 |
| IUPAC Name | 5-amino-1,3-dihydrobenzimidazol-2-one |
| InChI Key | BCXSVFBDMPSKPT-UHFFFAOYSA-N |
| Molecular Formula | C7H7N3O |
2-Acetamido-5-bromopyridine 98.0+%, TCI America™
CAS: 7169-97-3 Molecular Formula: C7H7BrN2O Molecular Weight (g/mol): 215.05 MDL Number: MFCD00468968 InChI Key: MJFCOXATGBYERZ-UHFFFAOYSA-N Synonym: 2-acetamido-5-bromopyridine,n-5-bromopyridin-2-yl acetamide,2-acetylamino-5-bromopyridine,acetamide, n-5-bromo-2-pyridinyl,n-5-bromo-2-pyridyl acetamide,n-5-bromo-2-pyridinyl acetamide,n-5-bromo-pyridin-2-yl-acetamide,n-acetylamino-5-bromopyridine,pubchem5546 PubChem CID: 293097 IUPAC Name: N-(5-bromopyridin-2-yl)acetamide SMILES: CC(=O)NC1=NC=C(C=C1)Br
| PubChem CID | 293097 |
|---|---|
| CAS | 7169-97-3 |
| Molecular Weight (g/mol) | 215.05 |
| MDL Number | MFCD00468968 |
| SMILES | CC(=O)NC1=NC=C(C=C1)Br |
| Synonym | 2-acetamido-5-bromopyridine,n-5-bromopyridin-2-yl acetamide,2-acetylamino-5-bromopyridine,acetamide, n-5-bromo-2-pyridinyl,n-5-bromo-2-pyridyl acetamide,n-5-bromo-2-pyridinyl acetamide,n-5-bromo-pyridin-2-yl-acetamide,n-acetylamino-5-bromopyridine,pubchem5546 |
| IUPAC Name | N-(5-bromopyridin-2-yl)acetamide |
| InChI Key | MJFCOXATGBYERZ-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrN2O |
3-Aminophenylboronic Acid Hemisulfate, TCI America™
CAS: 66472-86-4 Molecular Formula: C12H18B2N2O8S Molecular Weight (g/mol): 371.96 MDL Number: MFCD00013111 InChI Key: UKTAURVTSWDIQR-UHFFFAOYSA-N PubChem CID: 16211139 IUPAC Name: bis((3-aminophenyl)boronic acid); sulfuric acid SMILES: OS(O)(=O)=O.NC1=CC=CC(=C1)B(O)O.NC1=CC=CC(=C1)B(O)O
| PubChem CID | 16211139 |
|---|---|
| CAS | 66472-86-4 |
| Molecular Weight (g/mol) | 371.96 |
| MDL Number | MFCD00013111 |
| SMILES | OS(O)(=O)=O.NC1=CC=CC(=C1)B(O)O.NC1=CC=CC(=C1)B(O)O |
| IUPAC Name | bis((3-aminophenyl)boronic acid); sulfuric acid |
| InChI Key | UKTAURVTSWDIQR-UHFFFAOYSA-N |
| Molecular Formula | C12H18B2N2O8S |
Diammonium Ethylenediaminetetraacetate Monohydrate 98.0+%, TCI America™
CAS: 304675-80-7 Molecular Formula: C10H24N4O9 Molecular Weight (g/mol): 344.321 InChI Key: WRSUMHYBOYWMTD-UHFFFAOYSA-N Synonym: Diammonium EDTA, Ethylenediaminetetraacetic Acid Diammonium Salt PubChem CID: 18446095 IUPAC Name: diazanium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;hydrate SMILES: C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)O.[NH4+].[NH4+].O
| PubChem CID | 18446095 |
|---|---|
| CAS | 304675-80-7 |
| Molecular Weight (g/mol) | 344.321 |
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)O.[NH4+].[NH4+].O |
| Synonym | Diammonium EDTA, Ethylenediaminetetraacetic Acid Diammonium Salt |
| IUPAC Name | diazanium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;hydrate |
| InChI Key | WRSUMHYBOYWMTD-UHFFFAOYSA-N |
| Molecular Formula | C10H24N4O9 |
2-Acetamido-5-nitropyridine 98.0+%, TCI America™
CAS: 5093-64-1 Molecular Formula: C7H7N3O3 Molecular Weight (g/mol): 181.151 MDL Number: MFCD00833973 InChI Key: XKAASKOXADTLIG-UHFFFAOYSA-N Synonym: 2-acetamido-5-nitropyridine,n-5-nitropyridin-2-yl acetamide,n-5-nitro-2-pyridyl acetamide,n-5-nitro-2-pyridinyl acetamide,acetamide, n-5-nitro-2-pyridinyl,pubchem1226,acmc-1ap26,2-acetoamino-5-nitropyridine,ksc495i7p,2-acetylamino-5-nitropyridine PubChem CID: 345125 IUPAC Name: N-(5-nitropyridin-2-yl)acetamide SMILES: CC(=O)NC1=NC=C(C=C1)[N+](=O)[O-]
| PubChem CID | 345125 |
|---|---|
| CAS | 5093-64-1 |
| Molecular Weight (g/mol) | 181.151 |
| MDL Number | MFCD00833973 |
| SMILES | CC(=O)NC1=NC=C(C=C1)[N+](=O)[O-] |
| Synonym | 2-acetamido-5-nitropyridine,n-5-nitropyridin-2-yl acetamide,n-5-nitro-2-pyridyl acetamide,n-5-nitro-2-pyridinyl acetamide,acetamide, n-5-nitro-2-pyridinyl,pubchem1226,acmc-1ap26,2-acetoamino-5-nitropyridine,ksc495i7p,2-acetylamino-5-nitropyridine |
| IUPAC Name | N-(5-nitropyridin-2-yl)acetamide |
| InChI Key | XKAASKOXADTLIG-UHFFFAOYSA-N |
| Molecular Formula | C7H7N3O3 |
1-Acetylisatin 98.0+%, TCI America™
CAS: 574-17-4 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00158542 InChI Key: LPGDEHBASRKTDG-UHFFFAOYSA-N Synonym: 1-acetylisatin,n-acetylisatin,1-acetyl-1h-indole-2,3-dione,acetylisatin,1-acetylindoline-2,3-dione,1-acetyl-indole-2,3-dione,1h-indole-2,3-dione, 1-acetyl,indole-2,3-dione, 1-acetyl,1-acetyl-2,3-dihydro-1h-indole-2,3-dione,n-acetyl-isatin PubChem CID: 11321 ChEBI: CHEBI:16050 IUPAC Name: 1-acetyl-2,3-dihydro-1H-indole-2,3-dione SMILES: CC(=O)N1C(=O)C(=O)C2=CC=CC=C12
| PubChem CID | 11321 |
|---|---|
| CAS | 574-17-4 |
| Molecular Weight (g/mol) | 189.17 |
| ChEBI | CHEBI:16050 |
| MDL Number | MFCD00158542 |
| SMILES | CC(=O)N1C(=O)C(=O)C2=CC=CC=C12 |
| Synonym | 1-acetylisatin,n-acetylisatin,1-acetyl-1h-indole-2,3-dione,acetylisatin,1-acetylindoline-2,3-dione,1-acetyl-indole-2,3-dione,1h-indole-2,3-dione, 1-acetyl,indole-2,3-dione, 1-acetyl,1-acetyl-2,3-dihydro-1h-indole-2,3-dione,n-acetyl-isatin |
| IUPAC Name | 1-acetyl-2,3-dihydro-1H-indole-2,3-dione |
| InChI Key | LPGDEHBASRKTDG-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO3 |
1-Chloroethyl Ethyl Carbonate 98.0+%, TCI America™
CAS: 50893-36-2 Molecular Formula: C5H9ClO3 Molecular Weight (g/mol): 152.574 MDL Number: MFCD00040523 InChI Key: YVRGKFXJZCTTRB-UHFFFAOYSA-N Synonym: 1-chlorodiethyl carbonate,carbonic acid, 1-chloroethyl ethyl ester,1-chloroethyl ethylcarbonate,1-ethoxycarbonyloxyethyl chloride,carbonic acid 1-chloroethyl ethyl ester,1-chloroethylethylcarbonate,acmc-1aw9h,1-chloroethyl ethoxyformate,ethyl 1-chloroethyl carbonate,ksc490c2n PubChem CID: 162095 IUPAC Name: 1-chloroethyl ethyl carbonate SMILES: CCOC(=O)OC(C)Cl
| PubChem CID | 162095 |
|---|---|
| CAS | 50893-36-2 |
| Molecular Weight (g/mol) | 152.574 |
| MDL Number | MFCD00040523 |
| SMILES | CCOC(=O)OC(C)Cl |
| Synonym | 1-chlorodiethyl carbonate,carbonic acid, 1-chloroethyl ethyl ester,1-chloroethyl ethylcarbonate,1-ethoxycarbonyloxyethyl chloride,carbonic acid 1-chloroethyl ethyl ester,1-chloroethylethylcarbonate,acmc-1aw9h,1-chloroethyl ethoxyformate,ethyl 1-chloroethyl carbonate,ksc490c2n |
| IUPAC Name | 1-chloroethyl ethyl carbonate |
| InChI Key | YVRGKFXJZCTTRB-UHFFFAOYSA-N |
| Molecular Formula | C5H9ClO3 |
Ethyl 3-Cyclohexene-1-carboxylate 95.0+%, TCI America™
CAS: 15111-56-5 Molecular Formula: C9H14O2 Molecular Weight (g/mol): 154.209 MDL Number: MFCD00037158 InChI Key: BYNLHLLOIZDKIC-UHFFFAOYSA-N Synonym: 3-Cyclohexene-1-carboxylic Acid Ethyl Ester PubChem CID: 85803 IUPAC Name: ethyl cyclohex-3-ene-1-carboxylate SMILES: CCOC(=O)C1CCC=CC1
| PubChem CID | 85803 |
|---|---|
| CAS | 15111-56-5 |
| Molecular Weight (g/mol) | 154.209 |
| MDL Number | MFCD00037158 |
| SMILES | CCOC(=O)C1CCC=CC1 |
| Synonym | 3-Cyclohexene-1-carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl cyclohex-3-ene-1-carboxylate |
| InChI Key | BYNLHLLOIZDKIC-UHFFFAOYSA-N |
| Molecular Formula | C9H14O2 |
Cyclobutanecarboxylic Acid 97.0+%, TCI America™
CAS: 3721-95-7 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00001323 InChI Key: TXWOGHSRPAYOML-UHFFFAOYSA-N Synonym: cyclobutylcarboxylic acid,cyclo-butyl formic acid,cyclobutane carboxylic acid,unii-0rdj7c51o0,pubchem14139,acmc-1cnqb,cyclobutan carboxylic acid,cyclobutyl carboxylic acid,cyclobutancecarboxylic acid,cyclobutane-carboxylic acid PubChem CID: 19494 IUPAC Name: cyclobutanecarboxylic acid SMILES: OC(=O)C1CCC1
| PubChem CID | 19494 |
|---|---|
| CAS | 3721-95-7 |
| Molecular Weight (g/mol) | 100.12 |
| MDL Number | MFCD00001323 |
| SMILES | OC(=O)C1CCC1 |
| Synonym | cyclobutylcarboxylic acid,cyclo-butyl formic acid,cyclobutane carboxylic acid,unii-0rdj7c51o0,pubchem14139,acmc-1cnqb,cyclobutan carboxylic acid,cyclobutyl carboxylic acid,cyclobutancecarboxylic acid,cyclobutane-carboxylic acid |
| IUPAC Name | cyclobutanecarboxylic acid |
| InChI Key | TXWOGHSRPAYOML-UHFFFAOYSA-N |
| Molecular Formula | C5H8O2 |