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6-Nitro-2-phenyl[1,2,4]triazolo[1,5-a]pyridine

HCID 272196
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Basic information

CAS
31040-17-2
Standard SMILES
O=[N+]([O-])c1ccc2nc(-c3ccccc3)nn2c1
InChIKey
NYVFPMTVCIZFAY-UHFFFAOYSA-N
Molecular formula
C12H8N4O2
Average molar mass
240.22 g/mol
Monoisotopic mass
240.06472551

Names & identifiers

Preferred name
6-Nitro-2-phenyl[1,2,4]triazolo[1,5-a]pyridine
IUPAC
6-nitro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridine
English name
6-Nitro-2-phenyl[1,2,4]triazolo[1,5-a]pyridine
Molecular formula
C12H8N4O2
Molecular weight
240.22

Names & synonyms

31040-17-26-nitro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridine6-Nitro-2-phenyl[1,2,4]triazolo[1,5-a]pyridineNSC116468s-Triazolo[1,5-a]pyridine, 6-nitro-2-phenyl-DTXSID20297516NYVFPMTVCIZFAY-UHFFFAOYSA-Ns-Triazolo[1, 6-nitro-2-phenyl-NSC-1164686-Nitro-2-phenyl[1,2,4]triazolo[1,5-a]pyridine #[1,2,4]Triazolo[1,5-a]pyridine, 6-nitro-2-phenyl-

Database identifiers

CAS
31040-17-2
PubChem CID
272196
DTXSID
DTXSID20297516
Nikkaji
J103.010H

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
76 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Formal charge
0
Complexity
314

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