Benzaldehyde, 4-(methylsulfonyl)-


Chemical Name: Benzaldehyde, 4-(methylsulfonyl)-
CAS Number: 5398-77-6
Product Number: AG003445(AGN-PC-0JNA5U)
Synonyms:
MDL No:
Molecular Formula: C8H8O3S
Molecular Weight: 184.2123

Identification/Properties


Properties
MP:
155-161 °C
BP:
378.3°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.5151 (estimate)
Computed Properties
Molecular Weight:
184.209g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
184.019g/mol
Monoisotopic Mass:
184.019g/mol
Topological Polar Surface Area:
59.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
242
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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