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Home > Pyridines > 175135-28-1
175135-28-1 | 3-Pyridinecarboxamide, 2-(methylthio)-
CAS No: 175135-28-1 Catalog No: AG002070 MDL No:MFCD00052655
Product Description
Catalog Number:
AG002070
Chemical Name:
3-Pyridinecarboxamide, 2-(methylthio)-
CAS Number:
175135-28-1
Molecular Formula:
C7H8N2OS
Molecular Weight:
168.2162
MDL Number:
MFCD00052655
IUPAC Name:
2-methylsulfanylpyridine-3-carboxamide
InChI:
InChI=1S/C7H8N2OS/c1-11-7-5(6(8)10)3-2-4-9-7/h2-4H,1H3,(H2,8,10)
InChI Key:
YDYXNHSKBIZKFD-UHFFFAOYSA-N
SMILES:
CSc1ncccc1C(=O)N
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.036g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.214g/mol
Monoisotopic Mass:
168.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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