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89569-59-5 | [1,2,4]Triazolo[1,5-a]pyridine, 2-(4-chlorophenyl)-5,6,7,8-tetrahydro-
CAS No: 89569-59-5 Catalog No: AG003Z9W MDL No:
Product Description
Catalog Number:
AG003Z9W
Chemical Name:
[1,2,4]Triazolo[1,5-a]pyridine, 2-(4-chlorophenyl)-5,6,7,8-tetrahydro-
CAS Number:
89569-59-5
Molecular Formula:
C12H12ClN3
Molecular Weight:
233.6968
IUPAC Name:
2-(4-chlorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
InChI:
InChI=1S/C12H12ClN3/c13-10-6-4-9(5-7-10)12-14-11-3-1-2-8-16(11)15-12/h4-7H,1-3,8H2
InChI Key:
YJNIGPZZCMNOOA-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nc2n(n1)CCCC2
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.072g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.699g/mol
Monoisotopic Mass:
233.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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