Basic information
- CAS
76532-36-0- Standard SMILES
CNCc1cc2ccccc2c2ccccc12- InChIKey
LYPIOLDQSXVCPA-UHFFFAOYSA-N- Molecular formula
- C16H15N
- Average molar mass
- 221.3 g/mol
- Monoisotopic mass
- 221.12044948
Names & identifiers
- Preferred name
- N-Methyl-9-phenanthrenemethanamine
- IUPAC
- N-methyl-1-phenanthren-9-ylmethanamine
Names & synonyms
N-Methyl-9-phenanthrenemethanamine76532-36-0RefChem:163717LYPIOLDQSXVCPA-UHFFFAOYSA-NSCHEMBL1254044DTXSID101298518N-Methyl(9-phenanthryl)methanamine #N-Methyl-1-(phenanthren-9-yl)methanamine
Database identifiers
- CAS
76532-36-0- PubChem CID
- 605752
- DTXSID
DTXSID101298518
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…