2-Propanone, 1-(phenylsulfonyl)-


Chemical Name: 2-Propanone, 1-(phenylsulfonyl)-
CAS Number: 5000-44-2
Product Number: AG003O19(AGN-PC-0JVO2S)
Synonyms:
MDL No:
Molecular Formula: C9H10O3S
Molecular Weight: 198.2389

Identification/Properties


Properties
MP:
55-59 °C(lit.)
Form:
Solid
Computed Properties
Molecular Weight:
198.236g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
198.035g/mol
Monoisotopic Mass:
198.035g/mol
Topological Polar Surface Area:
59.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
268
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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