Basic information
- Standard SMILES
COc1cc(-c2cccc(C(=O)O)c2)cc(OC)c1OC- InChIKey
OXXAEGVEBNPTFY-UHFFFAOYSA-N- Molecular formula
- C16H16O5
- Average molar mass
- 288.29 g/mol
Names & identifiers
- Preferred name
- 3-(3,4,5-Trimethoxyphenyl)benzoic acid
- IUPAC
- 3-(3,4,5-trimethoxyphenyl)benzoic acid
Names & synonyms
3-(3,4,5-trimethoxyphenyl)benzoic acidSCHEMBL4121356SCHEMBL31431633OXXAEGVEBNPTFY-UHFFFAOYSA-NAKOS004116350
Database identifiers
- PubChem CID
- 22558066
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 332
Related reactions
4 records
Compound notes
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