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Home > Bromides > 1319196-83-2
1319196-83-2 | 1,2,4-Triazolo[4,3-a]pyridine, 3-(2-bromo-3-methylphenyl)-
CAS No: 1319196-83-2 Catalog No: AG000ZWL MDL No:
Product Description
Catalog Number:
AG000ZWL
Chemical Name:
1,2,4-Triazolo[4,3-a]pyridine, 3-(2-bromo-3-methylphenyl)-
CAS Number:
1319196-83-2
Molecular Formula:
C13H10BrN3
Molecular Weight:
288.1426
IUPAC Name:
3-(2-bromo-3-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C13H10BrN3/c1-9-5-4-6-10(12(9)14)13-16-15-11-7-2-3-8-17(11)13/h2-8H,1H3
InChI Key:
WNRRWBIEXMUTKZ-UHFFFAOYSA-N
SMILES:
Brc1c(C)cccc1c1nnc2n1cccc2
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.006g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.148g/mol
Monoisotopic Mass:
287.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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