372-31-6
Product Name:
Ethyl 4,4,4-trifluoroacetoacetate
Formula:
C6H7F3O3
Synonyms:
ETFAA;Ethyl 3-oxo-4,4,4-trifluorobutyrate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
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Vapor Pressure | 6.0 [mmHg] |
Chemical Classes | Other Classes -> Halogenated Esters |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H226:Flammable liquids H302:Acute toxicity,oral H412:Hazardous to the aquatic environment, long-term hazard |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P273:Avoid release to the environment. |
COMPUTED DESCRIPTORS
Molecular Weight | 184.11 g/mol |
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XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 184.03472857 g/mol |
Monoisotopic Mass | 184.03472857 g/mol |
Topological Polar Surface Area | 43.4 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 185 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |