Basic information
- CAS
62230-41-5- Standard SMILES
Fc1ccc(-c2nccnn2)cc1- InChIKey
WRTMHYDSPXVBIB-UHFFFAOYSA-N- Molecular formula
- C9H6FN3
- Average molar mass
- 175.16 g/mol
- Monoisotopic mass
- 175.05457537
Names & identifiers
- Preferred name
- 3-(4-Fluorophenyl)-1,2,4-triazine
- IUPAC
- 3-(4-fluorophenyl)-1,2,4-triazine
Names & synonyms
3-(4-Fluorophenyl)-1,2,4-triazine62230-41-5DTXSID10494996RefChem:274591DTXCID50445806CHEMBL32459853-(p-fluorophenyl)-asym-triazine
Database identifiers
- CAS
62230-41-5- PubChem CID
- 12374485
- DTXSID
DTXSID10494996- ChEMBL
CHEMBL3245985
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 157
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…