Basic information
- Standard SMILES
COCCCc1cc(CCCOC)cc(C(=O)O)c1- InChIKey
ZCGGIZHTEPJLFX-UHFFFAOYSA-N- Molecular formula
- C15H22O4
- Average molar mass
- 266.33 g/mol
Names & identifiers
- Preferred name
- 3,5-Bis(3-methoxypropyl)benzoic acid
- IUPAC
- 3,5-bis(3-methoxypropyl)benzoic acid
Names & synonyms
SCHEMBL3132715ZCGGIZHTEPJLFX-UHFFFAOYSA-N3,5-bis(3-methoxypropyl)benzoic acid
Database identifiers
- PubChem CID
- 57456872
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 237
Related reactions
4 records
Compound notes
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