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1125405-40-4 | 1H,4H,5H,6H,7H-[1,2,3]triazolo[4,5-b]pyridine
CAS No: 1125405-40-4 Catalog No: AG01DYFI MDL No:MFCD18785591
Product Description
Catalog Number:
AG01DYFI
Chemical Name:
1H,4H,5H,6H,7H-[1,2,3]triazolo[4,5-b]pyridine
CAS Number:
1125405-40-4
Molecular Formula:
C5H8N4
Molecular Weight:
124.1438
MDL Number:
MFCD18785591
IUPAC Name:
4,5,6,7-tetrahydro-2H-triazolo[4,5-b]pyridine
InChI:
InChI=1S/C5H8N4/c1-2-4-5(6-3-1)8-9-7-4/h1-3H2,(H2,6,7,8,9)
InChI Key:
MMVALNFEBZDYTA-UHFFFAOYSA-N
SMILES:
C1CNc2c(C1)[nH]nn2
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.075g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
124.147g/mol
Monoisotopic Mass:
124.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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