Basic information
- CAS
13826-12-5- Standard SMILES
OCc1ccc(Oc2cccc(CO)c2)cc1- InChIKey
HDBZZKGKMSTWEK-UHFFFAOYSA-N- Molecular formula
- C14H14O3
- Average molar mass
- 230.26 g/mol
- Monoisotopic mass
- 230.0942943
Names & identifiers
- Preferred name
- Benzenemethanol, 3-[4-(hydroxymethyl)phenoxy]-
- IUPAC
- [4-[3-(hydroxymethyl)phenoxy]phenyl]methanol
Names & synonyms
13826-12-5(3-(4-(hydroxymethyl)phenoxy)phenyl)methanol{3-[4-(HYDROXYMETHYL)PHENOXY]PHENYL}METHANOLBenzenemethanol, 3-[4-(hydroxymethyl)phenoxy]-DTXSID60463758AKOS010945538
Database identifiers
- CAS
13826-12-5- PubChem CID
- 11368207
- DTXSID
DTXSID60463758
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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