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Home > Pyridines > 182233-57-4
182233-57-4 | Pyridine, 4-methyl-2-(methylsulfonyl)-
CAS No: 182233-57-4 Catalog No: AG0023HM MDL No:
Product Description
Catalog Number:
AG0023HM
Chemical Name:
Pyridine, 4-methyl-2-(methylsulfonyl)-
CAS Number:
182233-57-4
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
IUPAC Name:
4-methyl-2-methylsulfonylpyridine
InChI:
InChI=1S/C7H9NO2S/c1-6-3-4-8-7(5-6)11(2,9)10/h3-5H,1-2H3
InChI Key:
SUWLYJOIXOWQAO-UHFFFAOYSA-N
SMILES:
Cc1ccnc(c1)S(=O)(=O)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.035g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.214g/mol
Monoisotopic Mass:
171.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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