Basic information
- CAS
29366-00-5- Standard SMILES
Cc1cc(Cc2cc(C)c(O)c(C)c2C)cc(C)c1O- InChIKey
IILSGKJHBUNVES-UHFFFAOYSA-N- Molecular formula
- C18H22O2
- Average molar mass
- 270.4 g/mol
- Monoisotopic mass
- 270.16197994
Names & identifiers
- Preferred name
- 4-[(4-Hydroxy-3,5-dimethylphenyl)methyl]-2,3,6-trimethylphenol
- IUPAC
- 4-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2,3,6-trimethylphenol
- English name
- 4-(4-Hydroxy-2,3,5-trimethylphenylmethyl)-2,6-dimethylphenol
- Molecular weight
- 0
Names & synonyms
4-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2,3,6-trimethylphenolMesitol, .alpha.4-(4-hydroxy-2,3,5-trimethylphenyl)-29366-00-5DTXSID10347357IILSGKJHBUNVES-UHFFFAOYSA-Nα4-(4-Hydroxy-2,3,5-trimethylphenyl)mesitol4-(4-Hydroxy-2,3,5-trimethylphenylmethyl)-2,6-dimethylphenol
Database identifiers
- CAS
29366-00-5- PubChem CID
- 620503
- DTXSID
DTXSID10347357- Nikkaji
- J112.452H
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 305
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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