Chavicinic acid
(2Z,4Z)-5-(1,3-benzodioxol-5-yl)penta-2,4-dienoic acid
Also Known As: Chavicinic acid|Piperonic acid|Piperic acid, (Z,E)-|Piperic acid (Z,E)-form [MI]|PIPERIC ACID, (Z,Z)-|PIPERIC ACID (Z,Z)-FORM [MI]|NCGC00014297-02|NCGC00097406-01|2,4-Pentadienoic acid, 5-(1,3-benzodioxol-5-yl)-, (Z,E)-|5-(1,3-Benzodioxol-5-yl)-2,4-pentadienoic acid, (2Z,4E)-|2,4-Pentadienoic acid, 5-(1,3-benzodioxol-5-yl)-, (2Z,4E)-|(2Z,4Z)-5-(1,3-benzodioxol-5-yl)penta-2,4-dienoic acid|2,4-PENTADIENOIC ACID, 5-(1,3-BENZODIOXOL-5-YL)-, (2Z,4Z)-|2,4-PENTADIENOIC ACID, 5-(1,3-BENZODIOXOL-5-YL)-, (Z,Z)-|5-(1,3-BENZODIOXOL-5-YL)-2,4-PENTADIENOIC ACID, (2Z,4Z)-
| Molecular Formula | C12H10O4 |
|---|---|
| Molecular Weight | 218.0579 g/mol |
| LogP | 2.0693 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.0579 |
| Monoisotopic Mass | 218.0579 |
| Heavy Atoms | 16 |
| Complexity | 460.0866 |
Chemical Identifiers
| CAS Number | 495-89-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C\C=C/C(=O)O |
Product Overview
Chavicinic acid (CAS 495-89-6), with molecular formula C12H10O4 and molecular weight 218.0579 g/mol. IUPAC: (2Z,4Z)-5-(1,3-benzodioxol-5-yl)penta-2,4-dienoic acid.