400-54-4

Name 1,1,1-TRIFLUORO-2,4-HEXANEDIONE
CAS 400-54-4
EINECS(EC#) 206-924-2
Molecular Formula C6H7F3O2
MDL Number MFCD00051306
Molecular Weight 168.11
MOL File 400-54-4.mol
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Chemical Properties

Appearance clear yellow liquid
Boiling point  125 °C
density  1.22 g/cm3
refractive index  1.3931-1.3951
Fp  28 °C
storage temp.  Flammables area
form  Liquid
pka 6.60±0.10(Predicted)
color  Clear yellow
InChI 1S/C6H7F3O2/c1-2-4(10)3-5(11)6(7,8)9/h2-3H2,1H3
InChIKey SBRYTXXHTKCMFT-UHFFFAOYSA-N
SMILES CCC(=O)CC(=O)C(F)(F)F
EPA Substance Registry System 2,4-Hexanedione, 1,1,1-trifluoro- (400-54-4)

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  WGK 3
Hazard Note  Irritant
TSCA  TSCA listed
HS Code  29147000
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3

Hazard Information

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