Basic information
- Standard SMILES
C=C(C)c1cc(C(=O)OC)c(OC)cc1OC- InChIKey
MXRSSKZIPAZGDJ-UHFFFAOYSA-N- Molecular formula
- C13H16O4
- Average molar mass
- 236.26 g/mol
Names & identifiers
- Preferred name
- 5-Isopropenyl-2,4-dimethoxy-benzoic acid methyl ester
- IUPAC
- methyl 2,4-dimethoxy-5-prop-1-en-2-ylbenzoate
Names & synonyms
5-isopropenyl-2,4-dimethoxy-benzoic acid methyl ester913000-27-8SCHEMBL383122MXRSSKZIPAZGDJ-UHFFFAOYSA-NDA-37258
Database identifiers
- PubChem CID
- 59263148
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 287
Related reactions
21 records
Compound notes
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