Basic information
- CAS
34616-48-3- Standard SMILES
Clc1ccccc1C=Nc1cccc2cnccc12- InChIKey
KDKDBZMUBVICPQ-UHFFFAOYSA-N- Molecular formula
- C16H11ClN2
- Average molar mass
- 266.72 g/mol
- Monoisotopic mass
- 266.0610761
Names & identifiers
- Preferred name
- 5-((o-Chlorobenzylidene)amino)isoquinoline
- IUPAC
- 1-(2-chlorophenyl)-N-isoquinolin-5-ylmethanimine
Names & synonyms
5-((o-Chlorobenzylidene)amino)isoquinolineISOQUINOLINE, 5-((o-CHLOROBENZYLIDENE)AMINO)-5-((2-Chlorobenzylidene)amino)isoquinoline34616-48-35-[(2-Chlorobenzylidene)amino]isoquinolineBRN 04013695-((2-Chlorobenzylidine)-amino)-isoquinolinePX3NNJ9ZH75-22-10-00343 (Beilstein Handbook Reference)5-Isoquinolinamine, N-[(2-chlorophenyl)methylene]-N-[(2-Chlorophenyl)methylene]-5-isoquinolinamine
Database identifiers
- CAS
34616-48-3- PubChem CID
- 36865
- UNII
- PX3NNJ9ZH7
- Nikkaji
- J86.385H
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…