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88974-93-0 | Pyridine, 2-(5-methyl-3-phenyl-1H-1,2,4-triazol-1-yl)-
CAS No: 88974-93-0 Catalog No: AG0045R7 MDL No:
Product Description
Catalog Number:
AG0045R7
Chemical Name:
Pyridine, 2-(5-methyl-3-phenyl-1H-1,2,4-triazol-1-yl)-
CAS Number:
88974-93-0
Molecular Formula:
C14H12N4
Molecular Weight:
236.2719
IUPAC Name:
2-(5-methyl-3-phenyl-1,2,4-triazol-1-yl)pyridine
InChI:
InChI=1S/C14H12N4/c1-11-16-14(12-7-3-2-4-8-12)17-18(11)13-9-5-6-10-15-13/h2-10H,1H3
InChI Key:
LEEYZYFJXXZYEZ-UHFFFAOYSA-N
SMILES:
Cc1nc(nn1c1ccccn1)c1ccccc1
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.278g/mol
Monoisotopic Mass:
236.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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