5-(4-Fluoro-2-methylphenyl)-1,2,4-triazin-3-amine
Basic information
- CAS
107128-48-3- Standard SMILES
Cc1cc(F)ccc1-c1cnnc(N)n1- InChIKey
WKOCFEMRXIEVNX-UHFFFAOYSA-N- Molecular formula
- C10H9FN4
- Average molar mass
- 204.2 g/mol
- Monoisotopic mass
- 204.08112447
Names & identifiers
- Preferred name
- 5-(4-Fluoro-2-methylphenyl)-1,2,4-triazin-3-amine
- IUPAC
- 5-(4-fluoro-2-methylphenyl)-1,2,4-triazin-3-amine
Names & synonyms
5-(4-Fluoro-2-methylphenyl)-1,2,4-triazin-3-amineDTXSID101234760107128-48-3
Database identifiers
- CAS
107128-48-3- PubChem CID
- 13622666
- DTXSID
DTXSID101234760
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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