Carboxylic acids and derivatives
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L-Dihydroorotic acid, 99%
CAS: 5988-19-2 Molecular Formula: C5H6N2O4 Molecular Weight (g/mol): 158.11 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
| PubChem CID | 439216 |
|---|---|
| CAS | 5988-19-2 |
| Molecular Weight (g/mol) | 158.11 |
| ChEBI | CHEBI:17025 |
| SMILES | C1C(NC(=O)NC1=O)C(=O)O |
| 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 |
| IUPAC Name | (4S)-2,6-dioxo-1,3-diazinane-4-carboxylic acid |
| InChI Key | UFIVEPVSAGBUSI-REOHCLBHSA-N |
| Molecular Formula | C5H6N2O4 |
Cyclopropylacetic acid, 97%
CAS: 5239-82-7 Molecular Formula: C5H8O22 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00041544 InChI Key: BXXOHRWKRXBZTG-UHFFFAOYSA-N Synonym: cyclopropylacetic acid,cyclopropaneacetic acid,cyclopropyl acetic acid,cyclopropyl-acetic acid,carboxymethyl cyclopropane,2-cyclopropyl-acetic acid,2-cyclopropylethanoic acid,acetic cyclopropyl acid,pubchem19703,2-cyclopropyl acetic acid PubChem CID: 138440 IUPAC Name: 2-cyclopropylacetic acid SMILES: CN1CCN(C)B1N=S=NB1N(C)CCN1C
| PubChem CID | 138440 |
|---|---|
| CAS | 5239-82-7 |
| Molecular Weight (g/mol) | 100.12 |
| MDL Number | MFCD00041544 |
| SMILES | CN1CCN(C)B1N=S=NB1N(C)CCN1C |
| Synonym | cyclopropylacetic acid,cyclopropaneacetic acid,cyclopropyl acetic acid,cyclopropyl-acetic acid,carboxymethyl cyclopropane,2-cyclopropyl-acetic acid,2-cyclopropylethanoic acid,acetic cyclopropyl acid,pubchem19703,2-cyclopropyl acetic acid |
| IUPAC Name | 2-cyclopropylacetic acid |
| InChI Key | BXXOHRWKRXBZTG-UHFFFAOYSA-N |
| Molecular Formula | C5H8O22 |
Ethyl methacrylate, 98+%, stab. with 10-120ppm, 4-methoxyphenol
CAS: 97-63-2 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00009161 InChI Key: SUPCQIBBMFXVTL-UHFFFAOYSA-N Synonym: ethyl methacrylate,ethyl 2-methylacrylate,2-propenoic acid, 2-methyl-, ethyl ester,methacrylic acid ethyl ester,ethyl 2-methyl-2-propenoate,ethyl 2-methacrylate,rhoplex ac-33,methacrylic acid, ethyl ester,rcra waste number u118,2-methylacrylic acid, ethyl ester PubChem CID: 7343 IUPAC Name: ethyl 2-methylprop-2-enoate SMILES: CCOC(=O)C(=C)C
| PubChem CID | 7343 |
|---|---|
| CAS | 97-63-2 |
| Molecular Weight (g/mol) | 114.144 |
| MDL Number | MFCD00009161 |
| SMILES | CCOC(=O)C(=C)C |
| Synonym | ethyl methacrylate,ethyl 2-methylacrylate,2-propenoic acid, 2-methyl-, ethyl ester,methacrylic acid ethyl ester,ethyl 2-methyl-2-propenoate,ethyl 2-methacrylate,rhoplex ac-33,methacrylic acid, ethyl ester,rcra waste number u118,2-methylacrylic acid, ethyl ester |
| IUPAC Name | ethyl 2-methylprop-2-enoate |
| InChI Key | SUPCQIBBMFXVTL-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
1-Formylpiperidine, 99%
CAS: 2591-86-8 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00006483 InChI Key: FEWLNYSYJNLUOO-UHFFFAOYSA-N Synonym: n-formylpiperidine,1-formylpiperidine,1-piperidinecarboxaldehyde,formylpiperidine,n-formylpiperidin,piperidinoformamide,piperidine-n-carbaldehyde,piperidine, 1-formyl,1-piperidinecarbaldehyde,unii-ziq29h6czg PubChem CID: 17429 ChEBI: CHEBI:42546 IUPAC Name: piperidine-1-carbaldehyde SMILES: C1CCN(CC1)C=O
| PubChem CID | 17429 |
|---|---|
| CAS | 2591-86-8 |
| Molecular Weight (g/mol) | 113.16 |
| ChEBI | CHEBI:42546 |
| MDL Number | MFCD00006483 |
| SMILES | C1CCN(CC1)C=O |
| Synonym | n-formylpiperidine,1-formylpiperidine,1-piperidinecarboxaldehyde,formylpiperidine,n-formylpiperidin,piperidinoformamide,piperidine-n-carbaldehyde,piperidine, 1-formyl,1-piperidinecarbaldehyde,unii-ziq29h6czg |
| IUPAC Name | piperidine-1-carbaldehyde |
| InChI Key | FEWLNYSYJNLUOO-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO |
4-Cyanophenylacetic acid, 97%
CAS: 5462-71-5 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD06798066 InChI Key: WEBXRQONNWEETE-UHFFFAOYSA-N Synonym: 2-4-cyanophenyl acetic acid,4-cyanophenylacetic acid,4-cyanophenyl acetic acid,benzeneacetic acid, 4-cyano,4-cyano-phenyl-acetic acid,p-cyanophenylacetic acid,4-cyanobenzeneacetic acid,p-cyanophenyl acetic acid,acetic acid, p-cyanophenyl PubChem CID: 79587 IUPAC Name: 2-(4-cyanophenyl)acetic acid SMILES: OC(=O)CC1=CC=C(C=C1)C#N
| PubChem CID | 79587 |
|---|---|
| CAS | 5462-71-5 |
| Molecular Weight (g/mol) | 161.16 |
| MDL Number | MFCD06798066 |
| SMILES | OC(=O)CC1=CC=C(C=C1)C#N |
| Synonym | 2-4-cyanophenyl acetic acid,4-cyanophenylacetic acid,4-cyanophenyl acetic acid,benzeneacetic acid, 4-cyano,4-cyano-phenyl-acetic acid,p-cyanophenylacetic acid,4-cyanobenzeneacetic acid,p-cyanophenyl acetic acid,acetic acid, p-cyanophenyl |
| IUPAC Name | 2-(4-cyanophenyl)acetic acid |
| InChI Key | WEBXRQONNWEETE-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2 |
Ethyl 3-(2-thienyl)-1H-pyrazole-5-carboxylate, 97%, Thermo Scientific™
CAS: 121195-03-7 Molecular Formula: C10H10N2O2S Molecular Weight (g/mol): 222.262 MDL Number: MFCD07772880 InChI Key: NTCRDZSJYGZRIE-UHFFFAOYSA-N Synonym: ethyl 5-thien-2-yl-1h-pyrazole-3-carboxylate,ethyl 3-thiophen-2-yl-1h-pyrazole-5-carboxylate,ethyl 5-2-thienyl pyrazole-3-carboxylate,ethyl 5-thiophen-2-yl-1h-pyrazole-3-carboxylate,ethyl 3-2-thienyl-1h-pyrazole-5-carboxylate,ethyl 5-thiophen-2-yl-2h-pyrazole-3-carboxylate,1h-pyrazole-3-carboxylic acid, 5-2-thienyl-, ethyl ester,1h-pyrazole-3-carboxylicacid, 5-2-thienyl-, ethyl ester,acmc-20mpcx,maybridge1_008811 PubChem CID: 2736478 IUPAC Name: ethyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylate SMILES: CCOC(=O)C1=NNC(=C1)C2=CC=CS2
| PubChem CID | 2736478 |
|---|---|
| CAS | 121195-03-7 |
| Molecular Weight (g/mol) | 222.262 |
| MDL Number | MFCD07772880 |
| SMILES | CCOC(=O)C1=NNC(=C1)C2=CC=CS2 |
| Synonym | ethyl 5-thien-2-yl-1h-pyrazole-3-carboxylate,ethyl 3-thiophen-2-yl-1h-pyrazole-5-carboxylate,ethyl 5-2-thienyl pyrazole-3-carboxylate,ethyl 5-thiophen-2-yl-1h-pyrazole-3-carboxylate,ethyl 3-2-thienyl-1h-pyrazole-5-carboxylate,ethyl 5-thiophen-2-yl-2h-pyrazole-3-carboxylate,1h-pyrazole-3-carboxylic acid, 5-2-thienyl-, ethyl ester,1h-pyrazole-3-carboxylicacid, 5-2-thienyl-, ethyl ester,acmc-20mpcx,maybridge1_008811 |
| IUPAC Name | ethyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylate |
| InChI Key | NTCRDZSJYGZRIE-UHFFFAOYSA-N |
| Molecular Formula | C10H10N2O2S |
Spectrum Chemical Manufacturing Corporation Methyl Methacrylate, 99%, Spectrum™ Chemical
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CAS: 80-62-6
| CAS | 80-62-6 |
|---|
Methyl cyclobutanecarboxylate, 98%
CAS: 765-85-5 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00095142 InChI Key: CBTGNLZUIZHUHY-UHFFFAOYSA-N Synonym: cyclobutanecarboxylic acid methyl ester,cyclobutanecarboxylic acid, methyl ester,pubchem23839,methyl cyclobutane carboxylate,cyclobutanecarboxylicacid,methylester,cyclobutanecarboxylicacid, methyl ester,cyclobutane carboxylic acid methyl ester PubChem CID: 136594 IUPAC Name: methyl cyclobutanecarboxylate SMILES: COC(=O)C1CCC1
| PubChem CID | 136594 |
|---|---|
| CAS | 765-85-5 |
| Molecular Weight (g/mol) | 114.14 |
| MDL Number | MFCD00095142 |
| SMILES | COC(=O)C1CCC1 |
| Synonym | cyclobutanecarboxylic acid methyl ester,cyclobutanecarboxylic acid, methyl ester,pubchem23839,methyl cyclobutane carboxylate,cyclobutanecarboxylicacid,methylester,cyclobutanecarboxylicacid, methyl ester,cyclobutane carboxylic acid methyl ester |
| IUPAC Name | methyl cyclobutanecarboxylate |
| InChI Key | CBTGNLZUIZHUHY-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
1,2-Bis(2-aminophenoxy)-ethane-N,N,N',N'-tetraacetic acid, tetrasodium salt hydrate, 95%
CAS: 336624-09-0 Molecular Formula: C22H20N2Na4O10 Molecular Weight (g/mol): 564.37 MDL Number: MFCD02683087 InChI Key: ZWSMLJACYSGFKD-UHFFFAOYSA-J Synonym: BAPTA tetrasodium salt IUPAC Name: tetrasodium 2-{[2-(2-{2-[bis(carboxylatomethyl)amino]phenoxy}ethoxy)phenyl](carboxylatomethyl)amino}acetate SMILES: [Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CC([O-])=O)C1=C(OCCOC2=C(C=CC=C2)N(CC([O-])=O)CC([O-])=O)C=CC=C1
| CAS | 336624-09-0 |
|---|---|
| Molecular Weight (g/mol) | 564.37 |
| MDL Number | MFCD02683087 |
| SMILES | [Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CC([O-])=O)C1=C(OCCOC2=C(C=CC=C2)N(CC([O-])=O)CC([O-])=O)C=CC=C1 |
| Synonym | BAPTA tetrasodium salt |
| IUPAC Name | tetrasodium 2-{[2-(2-{2-[bis(carboxylatomethyl)amino]phenoxy}ethoxy)phenyl](carboxylatomethyl)amino}acetate |
| InChI Key | ZWSMLJACYSGFKD-UHFFFAOYSA-J |
| Molecular Formula | C22H20N2Na4O10 |
Isopropyl acetate, 99+%, for analysis
CAS: 108-21-4 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.13 MDL Number: MFCD00008877 InChI Key: JMMWKPVZQRWMSS-UHFFFAOYSA-N Synonym: isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester PubChem CID: 7915 IUPAC Name: propan-2-yl acetate SMILES: CC(C)OC(=O)C
| PubChem CID | 7915 |
|---|---|
| CAS | 108-21-4 |
| Molecular Weight (g/mol) | 102.13 |
| MDL Number | MFCD00008877 |
| SMILES | CC(C)OC(=O)C |
| Synonym | isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester |
| IUPAC Name | propan-2-yl acetate |
| InChI Key | JMMWKPVZQRWMSS-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
Thermo Scientific Chemicals N-Isopropylacrylamide, 99%, pure, stabilized
CAS: 2210-25-5 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00041913 InChI Key: QNILTEGFHQSKFF-UHFFFAOYSA-N Synonym: n-isopropylacrylamide,nipam,n-iso-propylacrylamide,2-propenamide, n-1-methylethyl,isopropyl acrylamide,acrylamide, n-isopropyl,n-isopropyl acrylamide,n-1-methylethyl-2-propenamide,isopropylamid kyseliny akrylove,unii-b7gff17l9u PubChem CID: 16637 IUPAC Name: N-propan-2-ylprop-2-enamide SMILES: CC(C)NC(=O)C=C
| PubChem CID | 16637 |
|---|---|
| CAS | 2210-25-5 |
| Molecular Weight (g/mol) | 113.16 |
| MDL Number | MFCD00041913 |
| SMILES | CC(C)NC(=O)C=C |
| Synonym | n-isopropylacrylamide,nipam,n-iso-propylacrylamide,2-propenamide, n-1-methylethyl,isopropyl acrylamide,acrylamide, n-isopropyl,n-isopropyl acrylamide,n-1-methylethyl-2-propenamide,isopropylamid kyseliny akrylove,unii-b7gff17l9u |
| IUPAC Name | N-propan-2-ylprop-2-enamide |
| InChI Key | QNILTEGFHQSKFF-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO |
Ethyl Oleate, NF, Spectrum™ Chemical
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CAS: 111-62-6 Molecular Formula: C20H38O2 Molecular Weight (g/mol): 310.52 InChI Key: LVGKNOAMLMIIKO-VAWYXSNFSA-N IUPAC Name: ethyl (9E)-octadec-9-enoate SMILES: CCCCCCCC\C=C\CCCCCCCC(=O)OCC
| CAS | 111-62-6 |
|---|---|
| Molecular Weight (g/mol) | 310.52 |
| SMILES | CCCCCCCC\C=C\CCCCCCCC(=O)OCC |
| IUPAC Name | ethyl (9E)-octadec-9-enoate |
| InChI Key | LVGKNOAMLMIIKO-VAWYXSNFSA-N |
| Molecular Formula | C20H38O2 |
1,2,4-Benzenetricarboxylic anhydride, 97%
CAS: 552-30-7 Molecular Formula: C9H4O5 Molecular Weight (g/mol): 192.126 MDL Number: MFCD00005925 InChI Key: SRPWOOOHEPICQU-UHFFFAOYSA-N Synonym: trimellitic anhydride,1,2,4-benzenetricarboxylic anhydride,anhydrotrimellic acid,trimellitic acid anhydride,4-carboxyphthalic anhydride,tman,anhydrotrimellitic acid,trimellic acid anhydride,1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylic acid,trimellitic acid 1,2-anhydride PubChem CID: 11089 ChEBI: CHEBI:53050 IUPAC Name: 1,3-dioxo-2-benzofuran-5-carboxylic acid SMILES: C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O
| PubChem CID | 11089 |
|---|---|
| CAS | 552-30-7 |
| Molecular Weight (g/mol) | 192.126 |
| ChEBI | CHEBI:53050 |
| MDL Number | MFCD00005925 |
| SMILES | C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O |
| Synonym | trimellitic anhydride,1,2,4-benzenetricarboxylic anhydride,anhydrotrimellic acid,trimellitic acid anhydride,4-carboxyphthalic anhydride,tman,anhydrotrimellitic acid,trimellic acid anhydride,1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylic acid,trimellitic acid 1,2-anhydride |
| IUPAC Name | 1,3-dioxo-2-benzofuran-5-carboxylic acid |
| InChI Key | SRPWOOOHEPICQU-UHFFFAOYSA-N |
| Molecular Formula | C9H4O5 |
Methyl pyrrole-2-carboxylate, 97%, Thermo Scientific Chemicals
CAS: 1193-62-0 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.127 MDL Number: MFCD00817048 InChI Key: VONGYFFEWFJHNP-UHFFFAOYSA-N Synonym: methyl pyrrole-2-carboxylate,methyl 2-pyrrolecarboxylate,1h-pyrrole-2-carboxylic acid, methyl ester,unii-3beg2ck3lu,pyrrole-2-carboxylic acid methyl ester,methyl1h-pyrrole-2-carboxylate,3beg2ck3lu,1h-pyrrole-2-carboxylic acid,methyl ester,pubchem9141,acmc-1bsa1 PubChem CID: 136930 IUPAC Name: methyl 1H-pyrrole-2-carboxylate SMILES: COC(=O)C1=CC=CN1
| PubChem CID | 136930 |
|---|---|
| CAS | 1193-62-0 |
| Molecular Weight (g/mol) | 125.127 |
| MDL Number | MFCD00817048 |
| SMILES | COC(=O)C1=CC=CN1 |
| Synonym | methyl pyrrole-2-carboxylate,methyl 2-pyrrolecarboxylate,1h-pyrrole-2-carboxylic acid, methyl ester,unii-3beg2ck3lu,pyrrole-2-carboxylic acid methyl ester,methyl1h-pyrrole-2-carboxylate,3beg2ck3lu,1h-pyrrole-2-carboxylic acid,methyl ester,pubchem9141,acmc-1bsa1 |
| IUPAC Name | methyl 1H-pyrrole-2-carboxylate |
| InChI Key | VONGYFFEWFJHNP-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO2 |
| CAS | 5818-06-4 |
|---|---|
| ChEBI | CHEBI:39411 |
| MDL Number | MFCD00014759 |