2,6-Diethyl-3-methylphenol
Basic information
- CAS
104174-66-5- Standard SMILES
CCc1ccc(C)c(CC)c1O- InChIKey
LSOXOHJQVJVLLZ-UHFFFAOYSA-N- Molecular formula
- C11H16O
- Average molar mass
- 164.24 g/mol
- Monoisotopic mass
- 164.12011513
Names & identifiers
- Preferred name
- 2,6-Diethyl-3-methylphenol
- IUPAC
- 2,6-diethyl-3-methylphenol
Names & synonyms
2,6-Diethyl-3-methylphenol104174-66-5SCHEMBL13057531DTXSID00635134
Database identifiers
- CAS
104174-66-5- PubChem CID
- 23596994
- DTXSID
DTXSID00635134
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 133
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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