Basic information
- CAS
16899-25-5- Standard SMILES
CCCCCc1nc2c(c3c1CCCC3)CCCC2.Cl- InChIKey
NNIBUFPYKPIPOD-UHFFFAOYSA-N- Molecular formula
- C18H28ClN
- Average molar mass
- 293.9 g/mol
- Monoisotopic mass
- 293.1910276
Names & identifiers
- Preferred name
- Phenanthridine, 1,2,3,4,7,8,9,10-octahydro-6-pentyl-, hydrochloride (1:1)
- IUPAC
- 6-pentyl-1,2,3,4,7,8,9,10-octahydrophenanthridine;hydrochloride
Names & synonyms
Phenanthridine, 1,2,3,4,7,8,9,10-octahydro-6-pentyl-, hydrochlorideDTXSID8066131Phenanthridine, 1,2,3,4,7,8,9,10-octahydro-6-pentyl-, hydrochloride (1:1)RefChem:172612DTXCID903541616899-25-56-pentyl-1,2,3,4,7,8,9,10-octahydrophenanthridine hydrochloride(1:1)NNIBUFPYKPIPOD-UHFFFAOYSA-NAKOS0302398556-Pentyl-1,2,3,4,7,8,9,10-octahydrophenanthridine--hydrogen chloride (1/1)
Database identifiers
- CAS
16899-25-5- PubChem CID
- 85632
- DTXSID
DTXSID8066131
Properties
Computed structural properties
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 275
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenanthridine, 1,2,3,4,7,8,9,10-octahydro-6-pentyl-, hydrochloride (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…