Basic information
- CAS
5427-69-0- Standard SMILES
CN(C)Cc1cc(C(C)(C)C)cc(C2CCCC2)c1O- InChIKey
XMQYZODCLPZQHJ-UHFFFAOYSA-N- Molecular formula
- C18H29NO
- Average molar mass
- 275.4 g/mol
- Monoisotopic mass
- 275.22491455
Names & identifiers
- Preferred name
- 4-Tert-butyl-2-cyclopentyl-6-[(dimethylamino)methyl]phenol
- IUPAC
- 4-tert-butyl-2-cyclopentyl-6-[(dimethylamino)methyl]phenol
Names & synonyms
5427-69-04-tert-butyl-2-cyclopentyl-6-[(dimethylamino)methyl]phenolNSC13091DTXSID40279536NSC-13091
Database identifiers
- CAS
5427-69-0- PubChem CID
- 224535
- DTXSID
DTXSID40279536
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 301
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…