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3-Sulfolene Structure

3-Sulfolene

Chemical Properties

Melting point 65-66 °C(lit.)
Boiling point 190.71°C (rough estimate)
Density  1.3
bulk density 840kg/m3
refractive index  1.4765 (estimate)
Flash point >230 °F
storage temp.  Store below +30°C.
solubility  130g/l
form  Powder
color  Yellow to orange or light brown
Water Solubility  Soluble in water, ethanol, benzene, ether.
Merck  14,8956
BRN  107004
Henry's Law Constant 2.3×100 mol/(m3Pa) at 25℃, HSDB (2015)
Stability Stable, but decomposes above the melting point. Combustible. Incompatible with strong oxidizing agents.
InChI 1S/C4H6O2S/c5-7(6)3-1-2-4-7/h1-2H,3-4H2
InChIKey MBDNRNMVTZADMQ-UHFFFAOYSA-N
SMILES O=S1(=O)CC=CC1
CAS DataBase Reference 77-79-2(CAS DataBase Reference)
EPA Substance Registry System 3-Sulfolene (77-79-2)

Safety Information

Hazard Codes  Xi
Risk Statements  41
Safety Statements  26-37/39
RIDADR  UN 3335
WGK Germany  1
RTECS  XM9100000
TSCA  TSCA listed
HS Code  2934 99 90
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Hazardous Substances Data 77-79-2(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: 2547 mg/kg LD50 dermal Rabbit > 5000 mg/kg

MSDS

Usage And Synthesis

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