4-Nonanol, 1-(dimethylamino)-6,8,8-trimethyl-
Basic information
- CAS
5413-22-9- Standard SMILES
CC(CC(O)CCCN(C)C)CC(C)(C)C- InChIKey
JYASHYCLIUFILK-UHFFFAOYSA-N- Molecular formula
- C14H31NO
- Average molar mass
- 229.4 g/mol
- Monoisotopic mass
- 229.24056461
Names & identifiers
- Preferred name
- 4-Nonanol, 1-(dimethylamino)-6,8,8-trimethyl-
- IUPAC
- 1-(dimethylamino)-6,8,8-trimethylnonan-4-ol
Names & synonyms
5413-22-94-Nonanol, 1-(dimethylamino)-6,8,8-trimethyl-1-(dimethylamino)-6,8,8-trimethylnonan-4-olNSC64264-Nonanol,8,8-trimethyl-DTXSID20278148NSC-6426
Database identifiers
- CAS
5413-22-9- PubChem CID
- 221571
- DTXSID
DTXSID20278148
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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