Basic information
- CAS
391864-97-4- Standard SMILES
CCCCCCCCCCCCCCCCC(C)c1cccc(C)c1O- InChIKey
NDAHSKBCJUSOPB-UHFFFAOYSA-N- Molecular formula
- C25H44O
- Average molar mass
- 360.6 g/mol
- Monoisotopic mass
- 360.33921602
Names & identifiers
- Preferred name
- 2-Methyl-6-(octadecan-2-YL)phenol
- IUPAC
- 2-methyl-6-octadecan-2-ylphenol
Names & synonyms
391864-97-42-METHYL-6-(OCTADECAN-2-YL)PHENOLSCHEMBL4638724DTXSID30739871
Database identifiers
- CAS
391864-97-4- PubChem CID
- 69123714
- DTXSID
DTXSID30739871
Properties
Computed structural properties
- XLogP
- 11.2
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 16
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 301
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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