Basic information
- CAS
62230-37-9- Standard SMILES
Clc1ccc(-c2nncc(-c3ccccc3)n2)cc1- InChIKey
UWCINBOINDAQKN-UHFFFAOYSA-N- Molecular formula
- C15H10ClN3
- Average molar mass
- 267.71 g/mol
- Monoisotopic mass
- 267.056325
Names & identifiers
- Preferred name
- 3-(4-Chlorophenyl)-5-phenyl-1,2,4-triazine
- IUPAC
- 3-(4-chlorophenyl)-5-phenyl-1,2,4-triazine
Names & synonyms
3-(4-Chlorophenyl)-5-phenyl-1,2,4-triazine62230-37-9DTXSID70494992
Database identifiers
- CAS
62230-37-9- PubChem CID
- 12374481
- DTXSID
DTXSID70494992- Nikkaji
- J3.618.491D
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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