Basic information
- CAS
34883-05-1- Standard SMILES
COc1c(C)cc(C)c(O)c1C- InChIKey
KCBDCCLIAJJJAT-UHFFFAOYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Names & identifiers
- Preferred name
- 3-Methoxy-2,4,6-trimethylphenol
- IUPAC
- 3-methoxy-2,4,6-trimethylphenol
- English name
- 3-Methoxy-2,4,6-trimethylphenol
- Molecular formula
- C10H14O2
- Molecular weight
- 166.22
Names & synonyms
3-METHOXY-2,4,6-TRIMETHYLPHENOL34883-05-1Phenol, 3-methoxy-2,4,6-trimethyl-DTXSID90188442RefChem:94561DTXCID20110933KCBDCCLIAJJJAT-UHFFFAOYSA-N
Database identifiers
- CAS
34883-05-1- PubChem CID
- 36979
- DTXSID
DTXSID90188442- Nikkaji
- J100.236H
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 147
Physicochemical properties
- Boiling point
- 260.7 · 260.7±35.0 °C(Predicted)
- Density
- 1.034 · 1.034±0.06 g/cm3(Predicted)
- pka
- 10.61 · 10.61±0.28(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…