Basic information
- Standard SMILES
COCC(C)Oc1cc(O)cc(C(=O)O)c1- InChIKey
IJHZTGIAQNRARD-UHFFFAOYSA-N- Molecular formula
- C11H14O5
- Average molar mass
- 226.23 g/mol
Names & identifiers
- Preferred name
- 3-Hydroxy-5-(1-methoxypropan-2-yloxy)benzoic acid
- IUPAC
- 3-hydroxy-5-(1-methoxypropan-2-yloxy)benzoic acid
Names & synonyms
SCHEMBL2654383
Database identifiers
- PubChem CID
- 67485129
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 230
Related reactions
5 records
Compound notes
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