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Home > Pyridines > 116248-64-7
116248-64-7 | Pyridine, 2-[(4-methylphenyl)sulfinyl]-
CAS No: 116248-64-7 Catalog No: AG000C11 MDL No:
Product Description
Catalog Number:
AG000C11
Chemical Name:
Pyridine, 2-[(4-methylphenyl)sulfinyl]-
CAS Number:
116248-64-7
Molecular Formula:
C12H11NOS
Molecular Weight:
217.2868
IUPAC Name:
2-(4-methylphenyl)sulfinylpyridine
InChI:
InChI=1S/C12H11NOS/c1-10-5-7-11(8-6-10)15(14)12-4-2-3-9-13-12/h2-9H,1H3
InChI Key:
UTCOCCILAXKQSI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)c1ccccn1
Properties
Complexity:
224
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:
0
Isotope Atom Count:
0
Molecular Weight:
217.286g/mol
Monoisotopic Mass:
217.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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