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1019918-45-6 | 1,2,4-Triazolo[4,3-a]pyridine, 7-chloro-3-(2-fluorophenyl)-
CAS No: 1019918-45-6 Catalog No: AG000678 MDL No:
Product Description
Catalog Number:
AG000678
Chemical Name:
1,2,4-Triazolo[4,3-a]pyridine, 7-chloro-3-(2-fluorophenyl)-
CAS Number:
1019918-45-6
Molecular Formula:
C12H7ClFN3
Molecular Weight:
247.6555
IUPAC Name:
7-chloro-3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C12H7ClFN3/c13-8-5-6-17-11(7-8)15-16-12(17)9-3-1-2-4-10(9)14/h1-7H
InChI Key:
LBGTYPYWJPEDRO-UHFFFAOYSA-N
SMILES:
Clc1ccn2c(c1)nnc2c1ccccc1F
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.031g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.657g/mol
Monoisotopic Mass:
247.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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