Basic information
- CAS
92369-59-0- Standard SMILES
CCCCCCc1ccc(OCC)cc1O- InChIKey
HTCNWWOBQWBRBH-UHFFFAOYSA-N- Molecular formula
- C14H22O2
- Average molar mass
- 222.32 g/mol
- Monoisotopic mass
- 222.16197994
Names & identifiers
- Preferred name
- Phenol, 5-ethoxy-2-hexyl-
- IUPAC
- 5-ethoxy-2-hexylphenol
Names & synonyms
5-Ethoxy-2-hexylphenolPhenol, 5-ethoxy-2-hexyl-Hexylresorzin aethylaetherBRN 2263063Hexylresorzin aethylaether [German]92369-59-0DTXSID80238985RefChem:369344DTXCID30161476
Database identifiers
- CAS
92369-59-0- PubChem CID
- 3021981
- DTXSID
DTXSID80238985
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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