1-(Trifluoroacetyl)imidazole Structure

1-(Trifluoroacetyl)imidazole

Chemical Properties

Boiling point 137 °C(lit.)
Density  1.442 g/mL at 25 °C(lit.)
refractive index  n20/D 1.424(lit.)
Flash point 113 °F
storage temp.  2-8°C
solubility  sol most common solvents, e.g. ether, THF.
form  clear liquid
pka 0.78±0.10(Predicted)
Specific Gravity 1.442
color  Colorless to Yellow to Orange
Water Solubility  reacts
Sensitive  Moisture Sensitive
BRN  608904
InChI 1S/C5H3F3N2O/c6-5(7,8)4(11)10-2-1-9-3-10/h1-3H
InChIKey SINBGNJPYWNUQI-UHFFFAOYSA-N
SMILES FC(F)(F)C(=O)n1ccnc1
CAS DataBase Reference 1546-79-8(CAS DataBase Reference)
FDA UNII 8C6041OW3I
NIST Chemistry Reference N-Trifluoroacetylimidazole(1546-79-8)
UNSPSC Code 12352005
NACRES NA.22

Safety

Symbol(GHS) GHS hazard pictogramsGHS hazard pictograms
Signal wordWarning
Hazard statements H226-H315-H319-H335
Precautionary statements P210-P302+P352-P305+P351+P338
Hazard Codes  Xi,F,C
Risk Statements  10-36/37/38-34-22
Safety Statements  26-36/37-45-36/37/39-16
RIDADR  UN 1993 3/PG 3
WGK Germany  3
10-21
Hazard Note  Flammable/Moisture Sensitive/Keep Cold
TSCA  T
HazardClass  3
PackingGroup  III
HS Code  29332900
Storage Class 3 - Flammable liquids
Hazard Classifications Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3
NFPA 704:
2
3 0

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