2,6-Bis[(dimethylamino)methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
Basic information
- CAS
6285-80-9- Standard SMILES
CN(C)Cc1cc(C(C)(C)CC(C)(C)C)cc(CN(C)C)c1O- InChIKey
NOCZUJDWKXXYKK-UHFFFAOYSA-N- Molecular formula
- C20H36N2O
- Average molar mass
- 320.5 g/mol
- Monoisotopic mass
- 320.28276378
Names & identifiers
- Preferred name
- 2,6-Bis[(dimethylamino)methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
- IUPAC
- 2,6-bis[(dimethylamino)methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
Names & synonyms
6285-80-92,6-bis[(dimethylamino)methyl]-4-(2,4,4-trimethylpentan-2-yl)phenolNSC10653SCHEMBL6057576DTXSID20278926NSC-10653
Database identifiers
- CAS
6285-80-9- PubChem CID
- 223233
- DTXSID
DTXSID20278926
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 26.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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