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Home > Pyridines > 115768-79-1
115768-79-1 | 4(1H)-Pyridinone, 2-[2-(methylthio)phenyl]-
CAS No: 115768-79-1 Catalog No: AG00HD1Y MDL No:
Product Description
Catalog Number:
AG00HD1Y
Chemical Name:
4(1H)-Pyridinone, 2-[2-(methylthio)phenyl]-
CAS Number:
115768-79-1
IUPAC Name:
2-(2-methylsulfanylphenyl)-1H-pyridin-4-one
InChI:
InChI=1S/C12H11NOS/c1-15-12-5-3-2-4-10(12)11-8-9(14)6-7-13-11/h2-8H,1H3,(H,13,14)
InChI Key:
UFZHLWVFZLWYTR-UHFFFAOYSA-N
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.056g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.286g/mol
Monoisotopic Mass:
217.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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