a-Methyl-cis-aconitic acid
(Z)-2-(2-methoxy-2-oxoethyl)but-2-enedioic acid
Also Known As: a-methyl-cis-aconitic acid|2-(2-methoxy-2-oxoethyl)but-2-enedioate
CAS: 65146-85-2
| Molecular Formula | C7H8O6 |
|---|---|
| Molecular Weight | 188.03209 g/mol |
| LogP | -0.3549 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 188.03209 |
| Monoisotopic Mass | 188.03209 |
| Heavy Atoms | 13 |
| Complexity | 264.15634 |
Chemical Identifiers
| CAS Number | 65146-85-2 |
|---|---|
| SMILES | COC(=O)C/C(=C/C(=O)O)/C(=O)O |
Product Overview
a-Methyl-cis-aconitic acid (CAS 65146-85-2), with molecular formula C7H8O6 and molecular weight 188.03209 g/mol. IUPAC: (Z)-2-(2-methoxy-2-oxoethyl)but-2-enedioic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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