Benzenesulfonylacetone Structure

Benzenesulfonylacetone

Chemical Properties

Melting point 55-59 °C (lit.)
Boiling point 170 °C(Press: 0.1 Torr)
Density  1.228±0.06 g/cm3(Predicted)
Flash point >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)
UNSPSC Code 12352100

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P271-P261-P280
Hazard Codes  Xi
Safety Statements  24/25
WGK Germany  3
Hazard Note  Irritant
HS Code  29309090
Storage Class 11 - Combustible Solids
NFPA 704:
1
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