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7321-95-1 | 1H-Imidazo[4,5-c]pyridine, 1-methyl-2-(methylthio)-
CAS No: 7321-95-1 Catalog No: AG005FPG MDL No:MFCD00488852
Product Description
Catalog Number:
AG005FPG
Chemical Name:
1H-Imidazo[4,5-c]pyridine, 1-methyl-2-(methylthio)-
CAS Number:
7321-95-1
Molecular Formula:
C8H9N3S
Molecular Weight:
179.2422
MDL Number:
MFCD00488852
IUPAC Name:
1-methyl-2-methylsulfanylimidazo[4,5-c]pyridine
InChI:
InChI=1S/C8H9N3S/c1-11-7-3-4-9-5-6(7)10-8(11)12-2/h3-5H,1-2H3
InChI Key:
UIFMVOCSENMRMF-UHFFFAOYSA-N
SMILES:
CSc1nc2c(n1C)ccnc2
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.052g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.241g/mol
Monoisotopic Mass:
179.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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