Carboxylic acids and derivatives
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Methyl glycolate, 98%
CAS: 96-35-5 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.08 InChI Key: GSJFXBNYJCXDGI-UHFFFAOYSA-N Synonym: methyl glycolate,methyl hydroxyacetate,acetic acid, hydroxy-, methyl ester,glycolic acid, methyl ester,acetic acid, 2-hydroxy-, methyl ester,glycolic acid methyl ester,unii-7g7r729ej0,hydroxyacetic acid methyl ester,glycolic acid methyl,methyl2-hydroxyethanoate PubChem CID: 66774 IUPAC Name: methyl 2-hydroxyacetate SMILES: COC(=O)CO
| PubChem CID | 66774 |
|---|---|
| CAS | 96-35-5 |
| Molecular Weight (g/mol) | 90.08 |
| SMILES | COC(=O)CO |
| Synonym | methyl glycolate,methyl hydroxyacetate,acetic acid, hydroxy-, methyl ester,glycolic acid, methyl ester,acetic acid, 2-hydroxy-, methyl ester,glycolic acid methyl ester,unii-7g7r729ej0,hydroxyacetic acid methyl ester,glycolic acid methyl,methyl2-hydroxyethanoate |
| IUPAC Name | methyl 2-hydroxyacetate |
| InChI Key | GSJFXBNYJCXDGI-UHFFFAOYSA-N |
| Molecular Formula | C3H6O3 |
Methyl 3,5-diaminobenzoate, 99%
CAS: 1949-55-9 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00041433 InChI Key: IYWLDOMAEQHKJZ-UHFFFAOYSA-N Synonym: methyl 3,5-diaminobenzenecarboxylate,3,5-diaminobenzoic acid methyl ester,methyldiaminobenzenecarboxylate,3,5-diamino-benzoic acid methyl ester,benzoic acid,3,5-diamino-, methyl ester PubChem CID: 7010431 IUPAC Name: methyl 3,5-diaminobenzoate SMILES: COC(=O)C1=CC(=CC(=C1)N)N
| PubChem CID | 7010431 |
|---|---|
| CAS | 1949-55-9 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00041433 |
| SMILES | COC(=O)C1=CC(=CC(=C1)N)N |
| Synonym | methyl 3,5-diaminobenzenecarboxylate,3,5-diaminobenzoic acid methyl ester,methyldiaminobenzenecarboxylate,3,5-diamino-benzoic acid methyl ester,benzoic acid,3,5-diamino-, methyl ester |
| IUPAC Name | methyl 3,5-diaminobenzoate |
| InChI Key | IYWLDOMAEQHKJZ-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O2 |
Diethyl ethylidenemalonate, 99%
CAS: 1462-12-0 Molecular Formula: C9H14O4 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00009145 InChI Key: LBBAWVLUOZVYCC-UHFFFAOYSA-N Synonym: diethyl ethylidenemalonate,diethyl 2-ethylidenemalonate,propanedioic acid, ethylidene-, diethyl ester,1,3-diethyl 2-ethylidenepropanedioate,2-ethylidenemalonic acid diethyl ester,diethylethylidenemalonate,acmc-1c0mi,diethyl ethylidene malonate,diethyl ethylidenepropanedioate,diethyl 2-ethylidenemalonate # PubChem CID: 73831 SMILES: CCOC(=O)C(=CC)C(=O)OCC
| PubChem CID | 73831 |
|---|---|
| CAS | 1462-12-0 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00009145 |
| SMILES | CCOC(=O)C(=CC)C(=O)OCC |
| Synonym | diethyl ethylidenemalonate,diethyl 2-ethylidenemalonate,propanedioic acid, ethylidene-, diethyl ester,1,3-diethyl 2-ethylidenepropanedioate,2-ethylidenemalonic acid diethyl ester,diethylethylidenemalonate,acmc-1c0mi,diethyl ethylidene malonate,diethyl ethylidenepropanedioate,diethyl 2-ethylidenemalonate # |
| InChI Key | LBBAWVLUOZVYCC-UHFFFAOYSA-N |
| Molecular Formula | C9H14O4 |
Methyl trifluoroacetate, 99%
CAS: 431-47-0 Molecular Formula: C3H3F3O2 Molecular Weight (g/mol): 128.05 MDL Number: MFCD00000417 InChI Key: VMVNZNXAVJHNDJ-UHFFFAOYSA-N Synonym: methyl trifluoroacetate,trifluoroacetic acid methyl ester,acetic acid, trifluoro-, methyl ester,methyltrifluoroacetate,2,2,2-trifluoromethylacetate,acetic acid, 2,2,2-trifluoro-, methyl ester,methyl trifluoracetate,tfamt,methyl triflouroacetate,pubchem12490 PubChem CID: 9893 IUPAC Name: methyl 2,2,2-trifluoroacetate SMILES: COC(=O)C(F)(F)F
| PubChem CID | 9893 |
|---|---|
| CAS | 431-47-0 |
| Molecular Weight (g/mol) | 128.05 |
| MDL Number | MFCD00000417 |
| SMILES | COC(=O)C(F)(F)F |
| Synonym | methyl trifluoroacetate,trifluoroacetic acid methyl ester,acetic acid, trifluoro-, methyl ester,methyltrifluoroacetate,2,2,2-trifluoromethylacetate,acetic acid, 2,2,2-trifluoro-, methyl ester,methyl trifluoracetate,tfamt,methyl triflouroacetate,pubchem12490 |
| IUPAC Name | methyl 2,2,2-trifluoroacetate |
| InChI Key | VMVNZNXAVJHNDJ-UHFFFAOYSA-N |
| Molecular Formula | C3H3F3O2 |
Methyl 3,3-dimethylacrylate, 98%
CAS: 924-50-5 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00043940 InChI Key: FZIBCCGGICGWBP-UHFFFAOYSA-N Synonym: methyl 3-methyl-2-butenoate,methyl 3,3-dimethylacrylate,2-butenoic acid, 3-methyl-, methyl ester,3-methyl-but-2-enoic acid methyl ester,methyl senecioate,3,3-dimethylacrylic acid methyl ester,methyl-3,3-dimethylacrylate,crotonic acid, 3-methyl-, methyl ester,methyl-3,3-dimethyl acrylate,methylsenecioate PubChem CID: 13546 IUPAC Name: methyl 3-methylbut-2-enoate SMILES: CC(=CC(=O)OC)C
| PubChem CID | 13546 |
|---|---|
| CAS | 924-50-5 |
| Molecular Weight (g/mol) | 114.144 |
| MDL Number | MFCD00043940 |
| SMILES | CC(=CC(=O)OC)C |
| Synonym | methyl 3-methyl-2-butenoate,methyl 3,3-dimethylacrylate,2-butenoic acid, 3-methyl-, methyl ester,3-methyl-but-2-enoic acid methyl ester,methyl senecioate,3,3-dimethylacrylic acid methyl ester,methyl-3,3-dimethylacrylate,crotonic acid, 3-methyl-, methyl ester,methyl-3,3-dimethyl acrylate,methylsenecioate |
| IUPAC Name | methyl 3-methylbut-2-enoate |
| InChI Key | FZIBCCGGICGWBP-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
Ethyl 2-pentynoate, 97+%
CAS: 55314-57-3 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00015221 InChI Key: XDPRPKSTFBPPHU-UHFFFAOYSA-N PubChem CID: 99169 IUPAC Name: ethyl pent-2-ynoate SMILES: CCC#CC(=O)OCC
| PubChem CID | 99169 |
|---|---|
| CAS | 55314-57-3 |
| Molecular Weight (g/mol) | 126.155 |
| MDL Number | MFCD00015221 |
| SMILES | CCC#CC(=O)OCC |
| IUPAC Name | ethyl pent-2-ynoate |
| InChI Key | XDPRPKSTFBPPHU-UHFFFAOYSA-N |
| Molecular Formula | C7H10O2 |
Methyl 4-hydroxy-2-hexynoate, 97%
CAS: 112780-04-8 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD04039770 InChI Key: GMESNUCOCRRYJV-UHFFFAOYSA-N Synonym: methyl 4-hydroxy-2-hexynoate,4-hydroxy-2-hexynoic acid methyl ester,acmc-20akge,methyl-4-hydroxy-2-hexynoate,4-hydroxy-hex-2-ynoic acid methyl ester,2-hexynoic acid,4-hydroxy-, methyl ester PubChem CID: 13859766 IUPAC Name: methyl 4-hydroxyhex-2-ynoate SMILES: CCC(C#CC(=O)OC)O
| PubChem CID | 13859766 |
|---|---|
| CAS | 112780-04-8 |
| Molecular Weight (g/mol) | 142.154 |
| MDL Number | MFCD04039770 |
| SMILES | CCC(C#CC(=O)OC)O |
| Synonym | methyl 4-hydroxy-2-hexynoate,4-hydroxy-2-hexynoic acid methyl ester,acmc-20akge,methyl-4-hydroxy-2-hexynoate,4-hydroxy-hex-2-ynoic acid methyl ester,2-hexynoic acid,4-hydroxy-, methyl ester |
| IUPAC Name | methyl 4-hydroxyhex-2-ynoate |
| InChI Key | GMESNUCOCRRYJV-UHFFFAOYSA-N |
| Molecular Formula | C7H10O3 |
Methyl 4-methoxyphenylacetate, 97+%
CAS: 23786-14-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00008454 InChI Key: ZQYLDVNTWDEAJI-UHFFFAOYSA-N Synonym: methyl 4-methoxyphenylacetate,methyl 2-4-methoxyphenyl acetate,methyl 4-methoxyphenyl acetate,4-methoxyphenylacetic acid methyl ester,4-methoxy-phenyl-acetic acid methyl ester,methyl 4-methoxybenzeneacetate,methyl p-methoxyphenyl acetate,benzeneacetic acid, 4-methoxy-, methyl ester,acetic acid, p-methoxyphenyl-, methyl ester,methyl 2-p-methoxyphenyl acetate PubChem CID: 90266 IUPAC Name: methyl 2-(4-methoxyphenyl)acetate SMILES: COC(=O)CC1=CC=C(OC)C=C1
| PubChem CID | 90266 |
|---|---|
| CAS | 23786-14-3 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD00008454 |
| SMILES | COC(=O)CC1=CC=C(OC)C=C1 |
| Synonym | methyl 4-methoxyphenylacetate,methyl 2-4-methoxyphenyl acetate,methyl 4-methoxyphenyl acetate,4-methoxyphenylacetic acid methyl ester,4-methoxy-phenyl-acetic acid methyl ester,methyl 4-methoxybenzeneacetate,methyl p-methoxyphenyl acetate,benzeneacetic acid, 4-methoxy-, methyl ester,acetic acid, p-methoxyphenyl-, methyl ester,methyl 2-p-methoxyphenyl acetate |
| IUPAC Name | methyl 2-(4-methoxyphenyl)acetate |
| InChI Key | ZQYLDVNTWDEAJI-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
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 |
Dehydroacetic acid, 98%
CAS: 520-45-6 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00066709 InChI Key: PGRHXDWITVMQBC-UHFFFAOYSA-N Synonym: dehydroacetic acid,3-acetyl-6-methyl-2h-pyran-2,4 3h-dione,methylacetopyronone,dehydracetic acid,biocide 470f,acetic acid, dehydro,3-acetyl-6-methyl-2,4-pyrandione,2h-pyran-2,4 3h-dione, 3-acetyl-6-methyl,3-acetyl-6-methyl-pyran-2,4-dione,3-acetyl-6-methyldihydropyrandione-2,4 PubChem CID: 122903 IUPAC Name: 3-acetyl-6-methylpyran-2,4-dione SMILES: CC1=CC(=O)C(C(=O)O1)C(=O)C
| PubChem CID | 122903 |
|---|---|
| CAS | 520-45-6 |
| Molecular Weight (g/mol) | 168.148 |
| MDL Number | MFCD00066709 |
| SMILES | CC1=CC(=O)C(C(=O)O1)C(=O)C |
| Synonym | dehydroacetic acid,3-acetyl-6-methyl-2h-pyran-2,4 3h-dione,methylacetopyronone,dehydracetic acid,biocide 470f,acetic acid, dehydro,3-acetyl-6-methyl-2,4-pyrandione,2h-pyran-2,4 3h-dione, 3-acetyl-6-methyl,3-acetyl-6-methyl-pyran-2,4-dione,3-acetyl-6-methyldihydropyrandione-2,4 |
| IUPAC Name | 3-acetyl-6-methylpyran-2,4-dione |
| InChI Key | PGRHXDWITVMQBC-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
Methyl difluoroacetate, 98%
CAS: 433-53-4 Molecular Formula: C3H4F2O2 Molecular Weight (g/mol): 110.06 MDL Number: MFCD00039276 InChI Key: CSSYKHYGURSRAZ-UHFFFAOYSA-N Synonym: methyl difluoroacetate,methyl2,2-difluoroacetate,difluoroacetic acid methyl ester,acetic acid, difluoro-, methyl ester,methyldifluoroacetate,methyl difluoroacetate #,acmc-209ju0,methyl 2,2-difluoroethanoate PubChem CID: 79012 IUPAC Name: methyl 2,2-difluoroacetate SMILES: COC(=O)C(F)F
| PubChem CID | 79012 |
|---|---|
| CAS | 433-53-4 |
| Molecular Weight (g/mol) | 110.06 |
| MDL Number | MFCD00039276 |
| SMILES | COC(=O)C(F)F |
| Synonym | methyl difluoroacetate,methyl2,2-difluoroacetate,difluoroacetic acid methyl ester,acetic acid, difluoro-, methyl ester,methyldifluoroacetate,methyl difluoroacetate #,acmc-209ju0,methyl 2,2-difluoroethanoate |
| IUPAC Name | methyl 2,2-difluoroacetate |
| InChI Key | CSSYKHYGURSRAZ-UHFFFAOYSA-N |
| Molecular Formula | C3H4F2O2 |
Methyl p-toluate, 99%
CAS: 99-75-2 MDL Number: MFCD00008441 InChI Key: QSSJZLPUHJDYKF-UHFFFAOYSA-N Synonym: methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate PubChem CID: 7455 IUPAC Name: methyl 4-methylbenzoate SMILES: CC1=CC=C(C=C1)C(=O)OC
| PubChem CID | 7455 |
|---|---|
| CAS | 99-75-2 |
| MDL Number | MFCD00008441 |
| SMILES | CC1=CC=C(C=C1)C(=O)OC |
| Synonym | methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate |
| IUPAC Name | methyl 4-methylbenzoate |
| InChI Key | QSSJZLPUHJDYKF-UHFFFAOYSA-N |
Methyle3,4-diaminobenzoate, 97%, Thermo Scientific™
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
| PubChem CID | 135524 |
|---|---|
| CAS | 36692-49-6 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00017098 |
| SMILES | COC(=O)C1=CC=C(N)C(N)=C1 |
| 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 |
| IUPAC Name | methyl 3,4-diaminobenzoate |
| InChI Key | IOPLHGOSNCJOOO-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O2 |
Methyl methylsulfonylacetate, 98+%
CAS: 62020-09-1 Molecular Formula: C4H8O4S Molecular Weight (g/mol): 152.16 MDL Number: MFCD00051842 InChI Key: RQKDASVRZONLNQ-UHFFFAOYSA-N Synonym: methyl methanesulfonylacetate,methyl 2-methanesulfonylacetate,methyl 2-methylsulfonyl acetate,methyl methylsulfonylacetate,methanesulfonylacetic acid methyl ester,acmc-1b4fd,methyl methylsulfonyl acetate,2-methylsulfonyl-1-methoxyethanone,methylsulfonylacetic acid methyl ester,methanesulfonyl acetic acid methyl ester PubChem CID: 2759918 SMILES: COC(=O)CS(C)(=O)=O
| PubChem CID | 2759918 |
|---|---|
| CAS | 62020-09-1 |
| Molecular Weight (g/mol) | 152.16 |
| MDL Number | MFCD00051842 |
| SMILES | COC(=O)CS(C)(=O)=O |
| Synonym | methyl methanesulfonylacetate,methyl 2-methanesulfonylacetate,methyl 2-methylsulfonyl acetate,methyl methylsulfonylacetate,methanesulfonylacetic acid methyl ester,acmc-1b4fd,methyl methylsulfonyl acetate,2-methylsulfonyl-1-methoxyethanone,methylsulfonylacetic acid methyl ester,methanesulfonyl acetic acid methyl ester |
| InChI Key | RQKDASVRZONLNQ-UHFFFAOYSA-N |
| Molecular Formula | C4H8O4S |
Methyl isobutyrate, 98%
CAS: 547-63-7 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00008914 InChI Key: BHIWKHZACMWKOJ-UHFFFAOYSA-N Synonym: methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne PubChem CID: 11039 ChEBI: CHEBI:73689 IUPAC Name: methyl 2-methylpropanoate SMILES: CC(C)C(=O)OC
| PubChem CID | 11039 |
|---|---|
| CAS | 547-63-7 |
| Molecular Weight (g/mol) | 102.133 |
| ChEBI | CHEBI:73689 |
| MDL Number | MFCD00008914 |
| SMILES | CC(C)C(=O)OC |
| Synonym | methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne |
| IUPAC Name | methyl 2-methylpropanoate |
| InChI Key | BHIWKHZACMWKOJ-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |