Basic information
- CAS
24464-07-1- Standard SMILES
[Cl-].c1ccc(-c2cccc3c[nH+]ccc23)cc1- InChIKey
DLCLVMCKQPKKPR-UHFFFAOYSA-N- Molecular formula
- C15H12ClN
- Average molar mass
- 241.71 g/mol
- Monoisotopic mass
- 241.0658271
Names & identifiers
- Preferred name
- 5-Phenylisoquinoline--hydrogen chloride (1/1)
- IUPAC
- 5-phenylisoquinolin-2-ium chloride
Names & synonyms
24464-07-1DTXSID009473455-Phenylisoquinoline--hydrogen chloride (1/1)RefChem:1073234DTXCID3013756055-Phenylisoquinoline hydrochloride5-phenylisoquinolinium chlorideISOQUINOLINE, 5-PHENYL-, HYDROCHLORIDE
Database identifiers
- CAS
24464-07-1- PubChem CID
- 32387
Properties
Computed structural properties
- Topological polar surface area
- 14.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 219
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…