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Hexafluoroacetone sesquihydrate Structure

Hexafluoroacetone sesquihydrate

Chemical Properties

Melting point 10 °C
Density  1.69
vapor pressure  202 hPa ( 30 °C)
storage temp.  2-30°C
form  Liquid
Specific Gravity 1.690
color  Clear light yellow or amber
PH 1-2 (20°C in H2O)
Stability Stable. Reacts with DMSO.
InChI InChI=1S/C3F6O/c4-2(5,6)1(10)3(7,8)9
InChIKey VBZWSGALLODQNC-UHFFFAOYSA-N
SMILES C(F)(F)(F)C(=O)C(F)(F)F
EPA Substance Registry System Hexafluoroacetone sesquihydrate (13098-39-0)

Safety Information

Hazard Codes  Xi,T
Risk Statements  24/25-36/37/38-40
Safety Statements  36-45
RIDADR  2552
WGK Germany  WGK 3
RTECS  UC2660000
Hazard Note  Highly Toxic/Irritant
HazardClass  6.1(a)
PackingGroup  II
HS Code  29147000
Storage Class 6.1B - Non-combustible, acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 3 Dermal
Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Toxicity mouse,LD50,intraperitoneal,250mg/kg (250mg/kg),Journal of Medicinal Chemistry. Vol. 13, Pg. 1215, 1970.

Usage And Synthesis

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