Organic acids and derivatives
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Methyl cyclopentanecarboxylate, 97%
CAS: 4630-80-2 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00019290 InChI Key: IIHIJFJSXPDTNO-UHFFFAOYSA-N Synonym: cyclopentanecarboxylic acid, methyl ester,cyclopentanecarboxylic acid methyl ester,methyl cyclopentanoate,acmc-1am5n,methylcyclopentanecarboxylate,methylcyclopentane carboxylate,methyl cyclopentane carboxylate,methyl-1-cyclopentanecarboxylate,cyclopentanoic acid methyl ester,cyclopentanecarboxylic acid methyl PubChem CID: 78365 IUPAC Name: methyl cyclopentanecarboxylate SMILES: COC(=O)C1CCCC1
| PubChem CID | 78365 |
|---|---|
| CAS | 4630-80-2 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00019290 |
| SMILES | COC(=O)C1CCCC1 |
| Synonym | cyclopentanecarboxylic acid, methyl ester,cyclopentanecarboxylic acid methyl ester,methyl cyclopentanoate,acmc-1am5n,methylcyclopentanecarboxylate,methylcyclopentane carboxylate,methyl cyclopentane carboxylate,methyl-1-cyclopentanecarboxylate,cyclopentanoic acid methyl ester,cyclopentanecarboxylic acid methyl |
| IUPAC Name | methyl cyclopentanecarboxylate |
| InChI Key | IIHIJFJSXPDTNO-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
Methyl 3-(2-morpholin-4-ylethoxy)benzoate, 97%, Thermo Scientific™
CAS: 249937-00-6 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.31 MDL Number: MFCD08060518 InChI Key: VOYSHDFODOJUMP-UHFFFAOYSA-N Synonym: methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester PubChem CID: 7164628 IUPAC Name: methyl 3-(2-morpholin-4-ylethoxy)benzoate SMILES: COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1
| PubChem CID | 7164628 |
|---|---|
| CAS | 249937-00-6 |
| Molecular Weight (g/mol) | 265.31 |
| MDL Number | MFCD08060518 |
| SMILES | COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1 |
| Synonym | methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester |
| IUPAC Name | methyl 3-(2-morpholin-4-ylethoxy)benzoate |
| InChI Key | VOYSHDFODOJUMP-UHFFFAOYSA-N |
| Molecular Formula | C14H19NO4 |
Dimethyl 5-norbornene-2,3-dicarboxylate, 94%
CAS: 5826-73-3 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00154455 InChI Key: VGQLNJWOULYVFV-UHFFFAOYNA-N Synonym: dimethyl 5-norbornene-2,3-dicarboxylate,dimethyl bicyclo 2.2.1 hept-5-ene-2,3-dicarboxylate,dimethyl carbate,dimalone,nisy,compound 3,916,methyl 3-methoxycarbonyl bicyclo 2.2.1 hept-5-ene-2-carboxylate,acmc-1ah3y,norborn-5-ene-2endo,3endo-dicarboxylic acid dimethyl ester,5-norbornene-2, dimethyl ester PubChem CID: 38295 IUPAC Name: dimethyl bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate SMILES: COC(=O)C1C2CC(C=C2)C1C(=O)OC
| PubChem CID | 38295 |
|---|---|
| CAS | 5826-73-3 |
| Molecular Weight (g/mol) | 210.23 |
| MDL Number | MFCD00154455 |
| SMILES | COC(=O)C1C2CC(C=C2)C1C(=O)OC |
| Synonym | dimethyl 5-norbornene-2,3-dicarboxylate,dimethyl bicyclo 2.2.1 hept-5-ene-2,3-dicarboxylate,dimethyl carbate,dimalone,nisy,compound 3,916,methyl 3-methoxycarbonyl bicyclo 2.2.1 hept-5-ene-2-carboxylate,acmc-1ah3y,norborn-5-ene-2endo,3endo-dicarboxylic acid dimethyl ester,5-norbornene-2, dimethyl ester |
| IUPAC Name | dimethyl bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate |
| InChI Key | VGQLNJWOULYVFV-UHFFFAOYNA-N |
| Molecular Formula | C11H14O4 |
Methyl 2-bromo-3-fluoropropionate, 97%
CAS: 1537-52-6 Molecular Formula: C4H6BrFO2 Molecular Weight (g/mol): 184.99 MDL Number: MFCD09800641 InChI Key: BXTYDNLOFHBZFS-UHFFFAOYNA-N Synonym: 2-bromo-3-fluoropropionic acid methyl ester,methyl 2-bromo-3-fluoropropionate,methyl 2-bromo-3-fluoro-propanoate,methyl alpha-bromo-beta-fluoropropionate,methyl 2-bromo-3-fluoroproprionate,propanoic acid, 2-bromo-3-fluoro-, methyl ester PubChem CID: 5271584 IUPAC Name: methyl 2-bromo-3-fluoropropanoate SMILES: COC(=O)C(Br)CF
| PubChem CID | 5271584 |
|---|---|
| CAS | 1537-52-6 |
| Molecular Weight (g/mol) | 184.99 |
| MDL Number | MFCD09800641 |
| SMILES | COC(=O)C(Br)CF |
| Synonym | 2-bromo-3-fluoropropionic acid methyl ester,methyl 2-bromo-3-fluoropropionate,methyl 2-bromo-3-fluoro-propanoate,methyl alpha-bromo-beta-fluoropropionate,methyl 2-bromo-3-fluoroproprionate,propanoic acid, 2-bromo-3-fluoro-, methyl ester |
| IUPAC Name | methyl 2-bromo-3-fluoropropanoate |
| InChI Key | BXTYDNLOFHBZFS-UHFFFAOYNA-N |
| Molecular Formula | C4H6BrFO2 |
Mono-methyl phthalate, 98%
CAS: 4376-18-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00002466 InChI Key: FNJSWIPFHMKRAT-UHFFFAOYSA-N Synonym: 2-methoxycarbonyl benzoic acid,methyl hydrogen phthalate,monomethyl phthalate,mono-methyl phthalate,phthalic acid monomethyl ester,o-methoxycarbonyl benzoic acid,monomethyl 1,2-benzenedicarboxylate,phthalic acid, monomethyl ester,monomethylphthalate,unii-2stt6d18jr PubChem CID: 20392 IUPAC Name: 2-methoxycarbonylbenzoic acid SMILES: COC(=O)C1=CC=CC=C1C(O)=O
| PubChem CID | 20392 |
|---|---|
| CAS | 4376-18-5 |
| Molecular Weight (g/mol) | 180.16 |
| MDL Number | MFCD00002466 |
| SMILES | COC(=O)C1=CC=CC=C1C(O)=O |
| Synonym | 2-methoxycarbonyl benzoic acid,methyl hydrogen phthalate,monomethyl phthalate,mono-methyl phthalate,phthalic acid monomethyl ester,o-methoxycarbonyl benzoic acid,monomethyl 1,2-benzenedicarboxylate,phthalic acid, monomethyl ester,monomethylphthalate,unii-2stt6d18jr |
| IUPAC Name | 2-methoxycarbonylbenzoic acid |
| InChI Key | FNJSWIPFHMKRAT-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
Diethyl benzylidenemalonate, 98%
CAS: 5292-53-5 Molecular Formula: C14H16O4 Molecular Weight (g/mol): 248.28 MDL Number: MFCD00009149 InChI Key: VUWPIBNKJSEYIN-UHFFFAOYSA-N Synonym: diethyl benzylidenemalonate,diethyl benzalmalonate,diethyl 2-benzylidenemalonate,ethyl benzylidenemalonate,diethylbenzalmalonate,diethyl phenylmethylene malonate,malonic acid, benzylidene-, diethyl ester,diethylmalonate, benzal,benzylidenemalonic acid diethyl ester,propanedioic acid, phenylmethylene-, diethyl ester PubChem CID: 94751 IUPAC Name: diethyl 2-benzylidenepropanedioate SMILES: CCOC(=O)C(=CC1=CC=CC=C1)C(=O)OCC
| PubChem CID | 94751 |
|---|---|
| CAS | 5292-53-5 |
| Molecular Weight (g/mol) | 248.28 |
| MDL Number | MFCD00009149 |
| SMILES | CCOC(=O)C(=CC1=CC=CC=C1)C(=O)OCC |
| Synonym | diethyl benzylidenemalonate,diethyl benzalmalonate,diethyl 2-benzylidenemalonate,ethyl benzylidenemalonate,diethylbenzalmalonate,diethyl phenylmethylene malonate,malonic acid, benzylidene-, diethyl ester,diethylmalonate, benzal,benzylidenemalonic acid diethyl ester,propanedioic acid, phenylmethylene-, diethyl ester |
| IUPAC Name | diethyl 2-benzylidenepropanedioate |
| InChI Key | VUWPIBNKJSEYIN-UHFFFAOYSA-N |
| Molecular Formula | C14H16O4 |
Dimethyl trans-1,4-cyclohexanedicarboxylate, 99+%
CAS: 3399-22-2 Molecular Formula: C10H16O4 Molecular Weight (g/mol): 200.23 MDL Number: MFCD00063917,MFCD00001460,MFCD00216473 InChI Key: LNGAGQAGYITKCW-UHFFFAOYSA-N Synonym: dimethyl 1,4-cyclohexanedicarboxylate,dimethyl trans-1,4-cyclohexanedicarboxylate,1r,4r-dimethyl cyclohexane-1,4-dicarboxylate,cis-dimethyl cyclohexane-1,4-dicarboxylate,dimethyl trans-cyclohexane-1,4-dicarboxylate,1,4-cyclohexanedicarboxylic acid, dimethyl ester,dimethyl hexahydroterephthalate,trans-dimethyl cyclohexane-1,4-dicarboxylate,1,4-cyclohexanedicarboxylic acid, dimethyl ester, trans,unii-ys87mds0zv PubChem CID: 7198 IUPAC Name: dimethyl cyclohexane-1,4-dicarboxylate SMILES: COC(=O)C1CCC(CC1)C(=O)OC
| PubChem CID | 7198 |
|---|---|
| CAS | 3399-22-2 |
| Molecular Weight (g/mol) | 200.23 |
| MDL Number | MFCD00063917,MFCD00001460,MFCD00216473 |
| SMILES | COC(=O)C1CCC(CC1)C(=O)OC |
| Synonym | dimethyl 1,4-cyclohexanedicarboxylate,dimethyl trans-1,4-cyclohexanedicarboxylate,1r,4r-dimethyl cyclohexane-1,4-dicarboxylate,cis-dimethyl cyclohexane-1,4-dicarboxylate,dimethyl trans-cyclohexane-1,4-dicarboxylate,1,4-cyclohexanedicarboxylic acid, dimethyl ester,dimethyl hexahydroterephthalate,trans-dimethyl cyclohexane-1,4-dicarboxylate,1,4-cyclohexanedicarboxylic acid, dimethyl ester, trans,unii-ys87mds0zv |
| IUPAC Name | dimethyl cyclohexane-1,4-dicarboxylate |
| InChI Key | LNGAGQAGYITKCW-UHFFFAOYSA-N |
| Molecular Formula | C10H16O4 |
Vinyl benzoate, 95%
CAS: 769-78-8 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00048141 InChI Key: KOZCZZVUFDCZGG-UHFFFAOYSA-N Synonym: vinyl benzoate,benzoic acid vinyl ester,benzoic acid, ethenyl ester,benzoic acid, vinyl ester,unii-f1e7c1ggku,vinylester kyseliny benzoove,vinylester kyseliny benzoove czech,f1e7c1ggku,benzoic acid, ethenyl ester 9ci,benzoic acid vinyl PubChem CID: 13037 ChEBI: CHEBI:84279 IUPAC Name: ethenyl benzoate SMILES: C=COC(=O)C1=CC=CC=C1
| PubChem CID | 13037 |
|---|---|
| CAS | 769-78-8 |
| Molecular Weight (g/mol) | 148.161 |
| ChEBI | CHEBI:84279 |
| MDL Number | MFCD00048141 |
| SMILES | C=COC(=O)C1=CC=CC=C1 |
| Synonym | vinyl benzoate,benzoic acid vinyl ester,benzoic acid, ethenyl ester,benzoic acid, vinyl ester,unii-f1e7c1ggku,vinylester kyseliny benzoove,vinylester kyseliny benzoove czech,f1e7c1ggku,benzoic acid, ethenyl ester 9ci,benzoic acid vinyl |
| IUPAC Name | ethenyl benzoate |
| InChI Key | KOZCZZVUFDCZGG-UHFFFAOYSA-N |
| Molecular Formula | C9H8O2 |
4-(Methoxycarbonyl)cyclohexane-1-carboxylic acid, 97%
CAS: 32529-79-6 Molecular Formula: C9H14O4 Molecular Weight (g/mol): 186.207 MDL Number: MFCD06797561 InChI Key: ZQJNPHCQABYENK-UHFFFAOYSA-N Synonym: trans-1,4-cyclohexanedicarboxylic acid monomethyl ester,cis-4-methoxycarbonyl cyclohexanecarboxylic acid,trans-4-methoxycarbonyl cyclohexanecarboxylic acid,4-methoxycarbonyl cyclohexanecarboxylic acid,1r,4r-4-methoxycarbonyl cyclohexanecarboxylic acid,4-methoxycarbonyl cyclohexane-1-carboxylic acid,4-carbomethoxy-cyclohexane-1-carboxylic acid,trans-4-carbomethoxycyclohexane-1-carboxylic acid,1r,4r-4-methoxycarbonyl cyclohexane-1-carboxylic acid,trans-1,4-cyclohexane dicarboxylic acid monomethyl ester PubChem CID: 296850 IUPAC Name: 4-methoxycarbonylcyclohexane-1-carboxylic acid SMILES: COC(=O)C1CCC(CC1)C(=O)O
| PubChem CID | 296850 |
|---|---|
| CAS | 32529-79-6 |
| Molecular Weight (g/mol) | 186.207 |
| MDL Number | MFCD06797561 |
| SMILES | COC(=O)C1CCC(CC1)C(=O)O |
| Synonym | trans-1,4-cyclohexanedicarboxylic acid monomethyl ester,cis-4-methoxycarbonyl cyclohexanecarboxylic acid,trans-4-methoxycarbonyl cyclohexanecarboxylic acid,4-methoxycarbonyl cyclohexanecarboxylic acid,1r,4r-4-methoxycarbonyl cyclohexanecarboxylic acid,4-methoxycarbonyl cyclohexane-1-carboxylic acid,4-carbomethoxy-cyclohexane-1-carboxylic acid,trans-4-carbomethoxycyclohexane-1-carboxylic acid,1r,4r-4-methoxycarbonyl cyclohexane-1-carboxylic acid,trans-1,4-cyclohexane dicarboxylic acid monomethyl ester |
| IUPAC Name | 4-methoxycarbonylcyclohexane-1-carboxylic acid |
| InChI Key | ZQJNPHCQABYENK-UHFFFAOYSA-N |
| Molecular Formula | C9H14O4 |
Methyl Acetate, 96%, Spectrum™ Chemical
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CAS: 79-20-9
| CAS | 79-20-9 |
|---|
Methyl alpha-chloroacrylate, 98+%, stabilized with hydroquinone
CAS: 80-63-7 Molecular Formula: C4H5ClO2 Molecular Weight (g/mol): 120.54 MDL Number: MFCD00051368 InChI Key: AWJZTPWDQYFQPQ-UHFFFAOYSA-N Synonym: methyl 2-chloroacrylate,methyl alpha-chloroacrylate,methyl-2-chloroacrylate,2-propenoic acid, 2-chloro-, methyl ester,methyl-alpha-chloroacrylate,2-chloroacrylic acid, methyl ester,methyl 2-chloro-2-propenoate,acrylic acid, 2-chloro-, methyl ester,methyl 2-chloro-2-propenate,unii-47pg4l077j PubChem CID: 6659 IUPAC Name: methyl 2-chloroprop-2-enoate SMILES: COC(=O)C(=C)Cl
| PubChem CID | 6659 |
|---|---|
| CAS | 80-63-7 |
| Molecular Weight (g/mol) | 120.54 |
| MDL Number | MFCD00051368 |
| SMILES | COC(=O)C(=C)Cl |
| Synonym | methyl 2-chloroacrylate,methyl alpha-chloroacrylate,methyl-2-chloroacrylate,2-propenoic acid, 2-chloro-, methyl ester,methyl-alpha-chloroacrylate,2-chloroacrylic acid, methyl ester,methyl 2-chloro-2-propenoate,acrylic acid, 2-chloro-, methyl ester,methyl 2-chloro-2-propenate,unii-47pg4l077j |
| IUPAC Name | methyl 2-chloroprop-2-enoate |
| InChI Key | AWJZTPWDQYFQPQ-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClO2 |
Methyl pyruvate, 98%
CAS: 600-22-6 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.089 MDL Number: MFCD00008754 InChI Key: CWKLZLBVOJRSOM-UHFFFAOYSA-N Synonym: methyl pyruvate,pyruvic acid, methyl ester,pyruvic acid methyl ester,methyl 2-oxopropionate,propanoic acid, 2-oxo-, methyl ester,methyl-pyruvate,methylglyoxylic acid methyl ester,unii-3kjm65g5xl,3kjm65g5xl,2-oxo-propionic acid methyl ester PubChem CID: 11748 ChEBI: CHEBI:51850 IUPAC Name: methyl 2-oxopropanoate SMILES: CC(=O)C(=O)OC
| PubChem CID | 11748 |
|---|---|
| CAS | 600-22-6 |
| Molecular Weight (g/mol) | 102.089 |
| ChEBI | CHEBI:51850 |
| MDL Number | MFCD00008754 |
| SMILES | CC(=O)C(=O)OC |
| Synonym | methyl pyruvate,pyruvic acid, methyl ester,pyruvic acid methyl ester,methyl 2-oxopropionate,propanoic acid, 2-oxo-, methyl ester,methyl-pyruvate,methylglyoxylic acid methyl ester,unii-3kjm65g5xl,3kjm65g5xl,2-oxo-propionic acid methyl ester |
| IUPAC Name | methyl 2-oxopropanoate |
| InChI Key | CWKLZLBVOJRSOM-UHFFFAOYSA-N |
| Molecular Formula | C4H6O3 |
Methyl 3-mercaptopropionate, 98%
CAS: 2935-90-2 Molecular Formula: C4H8O2S Molecular Weight (g/mol): 120.166 MDL Number: MFCD00004895 InChI Key: LDTLDBDUBGAEDT-UHFFFAOYSA-N Synonym: methyl 3-mercaptopropionate,propanoic acid, 3-mercapto-, methyl ester,3-mercaptopropionic acid methyl ester,methyl mercaptopropionate,methyl3-mercaptopropionate,methyl 3-mercaptopropanoate,propionic acid, 3-mercapto-, methyl ester,unii-v920f0bcrz,methyl-3-mercaptopropionate,v920f0bcrz PubChem CID: 18050 IUPAC Name: methyl 3-sulfanylpropanoate SMILES: COC(=O)CCS
| PubChem CID | 18050 |
|---|---|
| CAS | 2935-90-2 |
| Molecular Weight (g/mol) | 120.166 |
| MDL Number | MFCD00004895 |
| SMILES | COC(=O)CCS |
| Synonym | methyl 3-mercaptopropionate,propanoic acid, 3-mercapto-, methyl ester,3-mercaptopropionic acid methyl ester,methyl mercaptopropionate,methyl3-mercaptopropionate,methyl 3-mercaptopropanoate,propionic acid, 3-mercapto-, methyl ester,unii-v920f0bcrz,methyl-3-mercaptopropionate,v920f0bcrz |
| IUPAC Name | methyl 3-sulfanylpropanoate |
| InChI Key | LDTLDBDUBGAEDT-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2S |
Ethyl 4-bromocrotonate, tech. 80%
CAS: 37746-78-4 Molecular Formula: C6H9BrO2 Molecular Weight (g/mol): 193.04 MDL Number: MFCD00000247 InChI Key: FHGRPBSDPBRTLS-ONEGZZNKSA-N Synonym: ethyl 4-bromocrotonate,e-ethyl 4-bromobut-2-enoate,ethyl 4-bromobut-2-enoate,4-bromocrotonic acid ethyl ester,ethyl 2e-4-bromobut-2-enoate,2-butenoic acid, 4-bromo-, ethyl ester, e,2-butenoic acid, 4-bromo-, ethyl ester,ethyl e-4-bromo-2-butenoate,ethyl e-4-bromobut-2-enoate,ethyl trans-4-bromo-2-butenoate PubChem CID: 5373944 IUPAC Name: ethyl (E)-4-bromobut-2-enoate SMILES: CCOC(=O)C=CCBr
| PubChem CID | 5373944 |
|---|---|
| CAS | 37746-78-4 |
| Molecular Weight (g/mol) | 193.04 |
| MDL Number | MFCD00000247 |
| SMILES | CCOC(=O)C=CCBr |
| Synonym | ethyl 4-bromocrotonate,e-ethyl 4-bromobut-2-enoate,ethyl 4-bromobut-2-enoate,4-bromocrotonic acid ethyl ester,ethyl 2e-4-bromobut-2-enoate,2-butenoic acid, 4-bromo-, ethyl ester, e,2-butenoic acid, 4-bromo-, ethyl ester,ethyl e-4-bromo-2-butenoate,ethyl e-4-bromobut-2-enoate,ethyl trans-4-bromo-2-butenoate |
| IUPAC Name | ethyl (E)-4-bromobut-2-enoate |
| InChI Key | FHGRPBSDPBRTLS-ONEGZZNKSA-N |
| Molecular Formula | C6H9BrO2 |
Methyl (R)-(+)-lactate, 98%
CAS: 17392-83-5 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004517 InChI Key: LPEKGGXMPWTOCB-UHFFFAOYNA-N Synonym: methyl r-+-lactate,methyl d-lactate,r-methyl 2-hydroxypropanoate,methyl r-lactate,+-methyl d-lactate,methyl 2r-2-hydroxypropanoate,d-lactic acid methyl ester,methyl lactate, +,unii-45mz1t3tbv,r-methyl lactate PubChem CID: 637514 ChEBI: CHEBI:74611 SMILES: COC(=O)C(C)O
| PubChem CID | 637514 |
|---|---|
| CAS | 17392-83-5 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:74611 |
| MDL Number | MFCD00004517 |
| SMILES | COC(=O)C(C)O |
| Synonym | methyl r-+-lactate,methyl d-lactate,r-methyl 2-hydroxypropanoate,methyl r-lactate,+-methyl d-lactate,methyl 2r-2-hydroxypropanoate,d-lactic acid methyl ester,methyl lactate, +,unii-45mz1t3tbv,r-methyl lactate |
| InChI Key | LPEKGGXMPWTOCB-UHFFFAOYNA-N |
| Molecular Formula | C4H8O3 |