3-(2,3-Dichlorophenyl)-6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridine
Basic information
- CAS
5954-56-3- Standard SMILES
FC(F)(F)c1ccc2nnc(-c3cccc(Cl)c3Cl)n2c1- InChIKey
MFIXNLIAXWEBMU-UHFFFAOYSA-N- Molecular formula
- C13H6Cl2F3N3
- Average molar mass
- 332.1 g/mol
- Monoisotopic mass
- 330.9890871
Names & identifiers
- Preferred name
- 3-(2,3-Dichlorophenyl)-6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridine
- IUPAC
- 3-(2,3-dichlorophenyl)-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
Names & synonyms
3-(2,3-dichlorophenyl)-6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridine3-(2,3-dichlorophenyl)-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine5954-56-3CBMicro_038225SCHEMBL6264252DTXSID70974946MFIXNLIAXWEBMU-UHFFFAOYSA-NSTK171632AKOS000603641ST109093BIM-0038284.P001AG-205/37199132
Show more names
SR-01000523763SR-01000523763-1312519-16-7
Database identifiers
- CAS
5954-56-3- PubChem CID
- 699185
- DTXSID
DTXSID70974946
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 382
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Related reactions
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Compound notes
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