Benzoic acid, 4-[[(4-methylphenyl)sulfonyl]methyl]-


Chemical Name: Benzoic acid, 4-[[(4-methylphenyl)sulfonyl]methyl]-
CAS Number: 110046-36-1
Product Number: AG019V39(AGN-PC-001PU0)
Synonyms:
MDL No:
Molecular Formula: C15H14O4S
Molecular Weight: 290.3343

Identification/Properties


Computed Properties
Molecular Weight:
290.3g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
290.06128g/mol
Monoisotopic Mass:
290.06128g/mol
Topological Polar Surface Area:
79.8Ų
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
421
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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