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7321-94-0 | 1-methyl-1H-imidazo[4,5-c]pyridine-2-thiol
CAS No: 7321-94-0 Catalog No: AG01C78A MDL No:MFCD21841413
Product Description
Catalog Number:
AG01C78A
Chemical Name:
1-methyl-1H-imidazo[4,5-c]pyridine-2-thiol
CAS Number:
7321-94-0
Molecular Formula:
C7H7N3S
Molecular Weight:
165.2156
MDL Number:
MFCD21841413
IUPAC Name:
1-methyl-3H-imidazo[4,5-c]pyridine-2-thione
InChI:
InChI=1S/C7H7N3S/c1-10-6-2-3-8-4-5(6)9-7(10)11/h2-4H,1H3,(H,9,11)
InChI Key:
GCYONDMJGUUSSV-UHFFFAOYSA-N
SMILES:
Cn1c(S)nc2c1ccnc2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.036g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.214g/mol
Monoisotopic Mass:
165.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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