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2-bromo-8-phenyl-[1,2,4]triazolo[1,5-a]pyridine

2-bromo-8-phenyl-[1,2,4]triazolo[1,5-a]pyridine

CAS: 1613380-42-9

Formula: C12H8BrN3

SMILES: BrC1=NN2C=CC=C(C2=N1)C1=CC=CC=C1

IUPAC: 2-bromo-8-phenyl-[1,2,4]triazolo[1,5-a]pyridine

InChI: InChI=1S/C12H8BrN3/c13-12-14-11-10(7-4-8-16(11)15-12)9-5-2-1-3-6-9/h1-8H

Composition: C (52.58%), H (2.94%), Br (29.15%), N (15.33%)

Molar Mass: 274.121

Atom Count: 24

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 272.99016
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey IKSNGEACZZVWSC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.99
Topological Polar Surface Area 30.19
Polarizability 26.15
Ring Count 3
Rotatable Bond Count 1

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