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34097-60-4

34097-60-4 structural image
Product Name: Methyl phenylsulfonylacetate
Formula: C9H10O4S
Synonyms: Methyl benzenesulfonylacetate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Clear light yellow viscous liquid; [Sigma-Aldrich MSDS] White solid; mp = 30 deg C; [Alfa Aesar MSDS]
Vapor Pressure 0.0000817 [mmHg]
Chemical Classes Other Classes -> Benzenesulfonic Acid Derivatives

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H227:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 214.24 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 214.02997997 g/mol
Monoisotopic Mass 214.02997997 g/mol
Topological Polar Surface Area 68.8 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 282
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