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Home > Imidazoles > 6953-55-5
6953-55-5 | 3H-Imidazo[4,5-b]pyridine-7-thiol
CAS No: 6953-55-5 Catalog No: AG005KWE MDL No:
Product Description
Catalog Number:
AG005KWE
Chemical Name:
3H-Imidazo[4,5-b]pyridine-7-thiol
CAS Number:
6953-55-5
Molecular Formula:
C6H5N3S
Molecular Weight:
151.1890
IUPAC Name:
1,4-dihydroimidazo[4,5-b]pyridine-7-thione
InChI:
InChI=1S/C6H5N3S/c10-4-1-2-7-6-5(4)8-3-9-6/h1-3H,(H2,7,8,9,10)
InChI Key:
ZJKISMRQYQWJJP-UHFFFAOYSA-N
SMILES:
Sc1ccnc2c1nc[nH]2
NSC Number:
71369
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.02g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
151.187g/mol
Monoisotopic Mass:
151.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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