Acetic acid, [[(4-methylphenyl)sulfonyl]oxy]-


Chemical Name: Acetic acid, [[(4-methylphenyl)sulfonyl]oxy]-
CAS Number: 39794-77-9
Product Number: AG003F4B(AGN-PC-0JO612)
Synonyms:
MDL No:
Molecular Formula: C9H10O5S
Molecular Weight: 230.2377

Identification/Properties


Properties
MP:
138.0 to 142.0 °C
BP:
424.3°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
230.234g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
230.025g/mol
Monoisotopic Mass:
230.025g/mol
Topological Polar Surface Area:
89A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
308
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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