Basic information
- Standard SMILES
COc1ccc(-c2cc(OC)c(OC)cc2C(=O)O)cc1OC- InChIKey
QXJNBZCLGYWBOH-UHFFFAOYSA-N- Molecular formula
- C17H18O6
- Average molar mass
- 318.32 g/mol
Names & identifiers
- Preferred name
- 2-(3,4-Dimethoxyphenyl)-4,5-dimethoxybenzoic acid
- IUPAC
- 2-(3,4-dimethoxyphenyl)-4,5-dimethoxybenzoic acid
Names & synonyms
SCHEMBL8427571QXJNBZCLGYWBOH-UHFFFAOYSA-N2-(3,4-dimethoxyphenyl)-4,5-dimethoxybenzoic acid
Database identifiers
- PubChem CID
- 15428753
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 387
Related reactions
3 records
Compound notes
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