4-(2,6-Dimethylphenoxy)-2,6-dimethylphenol
Basic information
- CAS
3698-40-6- Standard SMILES
Cc1cc(Oc2c(C)cccc2C)cc(C)c1O- InChIKey
BVJWEUYJIHKEJV-UHFFFAOYSA-N- Molecular formula
- C16H18O2
- Average molar mass
- 242.31 g/mol
- Monoisotopic mass
- 242.13067981
Names & identifiers
- Preferred name
- 4-(2,6-Dimethylphenoxy)-2,6-dimethylphenol
- IUPAC
- 4-(2,6-dimethylphenoxy)-2,6-dimethylphenol
Names & synonyms
4-(2,6-dimethylphenoxy)-2,6-dimethylphenol3698-40-6DTXSID70299146Phenol, 4-(2,6-dimethylphenoxy)-2,6-dimethyl-RefChem:96996DTXCID80250283BVJWEUYJIHKEJV-UHFFFAOYSA-NNSC 128397NSC128397SCHEMBL6703974NSC-1283974-(2,6-di-methylphenoxy)-2,6-dimethylphenol
Database identifiers
- CAS
3698-40-6- PubChem CID
- 278656
- DTXSID
DTXSID70299146- Nikkaji
- J928.870H
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 244
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Compound notes
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