5000-44-2

Name BENZENESULFONYLACETONE
CAS 5000-44-2
Molecular Formula C9H10O3S
MDL Number MFCD00047794
Molecular Weight 198.24
MOL File 5000-44-2.mol
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Chemical Properties

Appearance light yellow crystalline powder
Melting point  55-59 °C (lit.)
Boiling point  170 °C(Press: 0.1 Torr)
density  1.228±0.06 g/cm3(Predicted)
Fp  >230 °F
storage temp.  Store below +30°C.
form  solid
BRN  640928
InChI 1S/C9H10O3S/c1-8(10)7-13(11,12)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey YBLGSNMIIPIRFC-UHFFFAOYSA-N
SMILES CC(=O)CS(=O)(=O)c1ccccc1
CAS DataBase Reference 5000-44-2(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Safety Statements 
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
Hazard Note  Irritant
HS Code  29309090
Storage Class 11 - Combustible Solids

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