2-Cyclohexyl-6-[(diethylamino)methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
Basic information
- CAS
5427-81-6- Standard SMILES
CCN(CC)Cc1cc(C(C)(C)CC(C)(C)C)cc(C2CCCCC2)c1O- InChIKey
RSGYTWBZAYVJQX-UHFFFAOYSA-N- Molecular formula
- C25H43NO
- Average molar mass
- 373.6 g/mol
- Monoisotopic mass
- 373.334465
Names & identifiers
- Preferred name
- 2-Cyclohexyl-6-[(diethylamino)methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
- IUPAC
- 2-cyclohexyl-6-(diethylaminomethyl)-4-(2,4,4-trimethylpentan-2-yl)phenol
Names & synonyms
5427-81-62-cyclohexyl-6-[(diethylamino)methyl]-4-(2,4,4-trimethylpentan-2-yl)phenolNSC13106DTXSID70279544NSC-13106
Database identifiers
- CAS
5427-81-6- PubChem CID
- 224552
- DTXSID
DTXSID70279544
Properties
Computed structural properties
- XLogP
- 8.1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 428
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…