Basic information
- CAS
24464-42-4- Standard SMILES
CC1NCCc2ccc(-c3ccccc3)cc21- InChIKey
KABXWRKELYKSLZ-UHFFFAOYSA-N- Molecular formula
- C16H17N
- Average molar mass
- 223.31 g/mol
- Monoisotopic mass
- 223.13609955
Names & identifiers
- Preferred name
- 1-Methyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline
- IUPAC
- 1-methyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline
Names & synonyms
1,2,3,4-Tetrahydro-1-methyl-7-phenylisoquinoline24464-42-41-methyl-7-phenyl-1,2,3,4-tetrahydroisoquinolineDTXSID501237180AKOS006080053
Database identifiers
- CAS
24464-42-4- PubChem CID
- 32402
- DTXSID
DTXSID501237180
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…