Basic information
- CAS
79426-52-1- Standard SMILES
CCCCCCCCCC(CC)c1ccccc1O- InChIKey
UNPVPOMSLNIIDV-UHFFFAOYSA-N- Molecular formula
- C18H30O
- Average molar mass
- 262.4 g/mol
- Monoisotopic mass
- 262.22966558
Names & identifiers
- Preferred name
- 2-(Dodecan-3-yl)phenol
- IUPAC
- 2-dodecan-3-ylphenol
Names & synonyms
2-(Dodecan-3-yl)phenol2-(1-Ethyldecyl)phenolSCHEMBL109547SCHEMBL9797000UNPVPOMSLNIIDV-UHFFFAOYSA-NDTXSID80131434979426-52-1
Database identifiers
- CAS
79426-52-1- PubChem CID
- 12820018
- DTXSID
DTXSID801314349- Nikkaji
- J353.329H
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 10
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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