Basic information
- CAS
114828-91-0- Standard SMILES
OCC(O)COc1ccccc1C1CCCC1- InChIKey
PGDWHNSQWORASA-UHFFFAOYSA-N- Molecular formula
- C14H20O3
- Average molar mass
- 236.31 g/mol
- Monoisotopic mass
- 236.1412445
Names & identifiers
- Preferred name
- 3-(2-Cyclopentylphenoxy)-1,2-propanediol
- IUPAC
- 3-(2-cyclopentylphenoxy)propane-1,2-diol
Names & synonyms
114828-91-03-(2-Cyclopentylphenoxy)-1,2-propanediol3-(2-cyclopentylphenoxy)propane-1,2-diol1,2-Propanediol, 3-(2-cyclopentylphenoxy)-DTXSID10921510
Database identifiers
- CAS
114828-91-0- PubChem CID
- 150607
- DTXSID
DTXSID10921510
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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