Basic information
- CAS
875-63-8- Standard SMILES
CN1CCC[C@@H]2CCCC[C@H]21- InChIKey
AAARTTJTRNAYHQ-VHSXEESVSA-N- Molecular formula
- C10H19N
- Average molar mass
- 153.26 g/mol
- Monoisotopic mass
- 153.15174961
Names & identifiers
- Preferred name
- trans-Decahydro-1-methylquinoline
- IUPAC
- (4aS,8aR)-1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
Names & synonyms
trans-Decahydro-1-methylquinolineQuinoline, decahydro-1-methyl-, trans-875-63-89BNC3N94N9(4aS,8aR)-1-methyldecahydroquinolineN-methyl-trans-decahydroquinolineEINECS 212-875-8UNII-9BNC3N94N9SCHEMBL2603334trans-1-Methyldecahydroquinolinequinoline, decahydro-1-methyl-, (4aS,8aR)-InChI=1/C10H19N/c1-11-8-4-6-9-5-2-3-7-10(9)11/h9-10H,2-8H2,1H3/t9-,10+/m0/s
Database identifiers
- CAS
875-63-8- PubChem CID
- 101889
- EC Number
- 212-875-8
- Nikkaji
- J259.612A
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 133
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…