Basic information
- CAS
74916-44-2- Standard SMILES
Nc1nnc2cc(F)ccc2n1- InChIKey
GESXCEBKIYUDJL-UHFFFAOYSA-N- Molecular formula
- C7H5FN4
- Average molar mass
- 164.14 g/mol
- Monoisotopic mass
- 164.04982434
Names & identifiers
- Preferred name
- 7-Fluoro-1,2,4-benzotriazin-3-amine
- IUPAC
- 7-fluoro-1,2,4-benzotriazin-3-amine
- English name
- 1,2,4-Benzotriazin-3-amine, 7-fluoro-
- Molecular formula
- C7H5FN4
- Molecular weight
- 164.14
Names & synonyms
74916-44-27-FLUOROBENZO[E][1,2,4]TRIAZIN-3-AMINEMLS0031153501,2,4-BENZOTRIAZIN-3-AMINE, 7-FLUORO-7-fluoro-1,2,4-benzotriazin-3-amineNSC255327CHEMBL1882802SCHEMBL10957202DTXSID70312506GESXCEBKIYUDJL-UHFFFAOYSA-NAKOS006271762AT38581
Show more names
MB00339NSC-2553273-Amino-7-fluoro-1,2,4-benzotriazineSMR0018309287-Fluoro-1,2,4-benzotriazin-3-ylamine #
Database identifiers
- CAS
74916-44-2- PubChem CID
- 318596
- DTXSID
DTXSID70312506- ChEMBL
CHEMBL1882802
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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