Acetic acid, trifluoro-, 2-(5-phenyl-3-as-triazinyl)hydrazide
Basic information
- CAS
69466-53-1- Standard SMILES
O=C(NNc1nncc(-c2ccccc2)n1)C(F)(F)F- InChIKey
ZXVUJMFKAOAULH-UHFFFAOYSA-N- Molecular formula
- C11H8F3N5O
- Average molar mass
- 283.21 g/mol
- Monoisotopic mass
- 283.06809438
Names & identifiers
- Preferred name
- Acetic acid, trifluoro-, 2-(5-phenyl-3-as-triazinyl)hydrazide
- IUPAC
- 2,2,2-trifluoro-N'-(5-phenyl-1,2,4-triazin-3-yl)acetohydrazide
Names & synonyms
BRN 0553707ACETIC ACID, TRIFLUORO-, 2-(5-PHENYL-3-as-TRIAZINYL)HYDRAZIDE3-((Trifluoroacetyl)hydrazino)-5-phenyl-1,2,4-triazine69466-53-1Trifluoroacetic acid, 2-(5-phenyl-3-as-triazinyl)hydrazideDTXSID50219640RefChem:316729DTXCID001421312,2,2-trifluoro-N'-(5-phenyl-1,2,4-triazin-3-yl)acetohydrazideCHEMBL3247461SCHEMBL11275588ZXVUJMFKAOAULH-UHFFFAOYSA-N
Database identifiers
- CAS
69466-53-1- PubChem CID
- 50569
- DTXSID
DTXSID50219640- ChEMBL
CHEMBL3247461- Nikkaji
- J86.297E
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 333
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Compound notes
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