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Home > Pyridines > 1016839-90-9
1016839-90-9 | 2-methyl-4-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}aniline
CAS No: 1016839-90-9 Catalog No: AG01AAO6 MDL No:MFCD09944785
Product Description
Catalog Number:
AG01AAO6
Chemical Name:
2-methyl-4-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}aniline
CAS Number:
1016839-90-9
Molecular Formula:
C13H12N4
Molecular Weight:
224.2612
MDL Number:
MFCD09944785
IUPAC Name:
2-methyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)aniline
InChI:
InChI=1S/C13H12N4/c1-9-8-10(5-6-11(9)14)13-16-15-12-4-2-3-7-17(12)13/h2-8H,14H2,1H3
InChI Key:
WTOVBGFEPYHXQZ-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1C)c1nnc2n1cccc2
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.106g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.267g/mol
Monoisotopic Mass:
224.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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