Basic information
- CAS
42899-29-6- Standard SMILES
CC(=O)N1CCCC2=C1CCCC2- InChIKey
CVBLBVRSBFENTL-UHFFFAOYSA-N- Molecular formula
- C11H17NO
- Average molar mass
- 179.26 g/mol
- Monoisotopic mass
- 179.13101417
Names & identifiers
- Preferred name
- 1-(3,4,5,6,7,8-Hexahydroquinolin-1(2H)-yl)ethan-1-one
- IUPAC
- 1-(3,4,5,6,7,8-hexahydro-2H-quinolin-1-yl)ethanone
Names & synonyms
42899-29-6NSC278026DTXSID303138721-(3,4,5,6,7,8-Hexahydroquinolin-1(2H)-yl)ethan-1-oneNSC-278026
Database identifiers
- CAS
42899-29-6- PubChem CID
- 322110
- DTXSID
DTXSID30313872
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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