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 |
|---|---|
| Vapor Pressure | 6.0 [mmHg] |
| Chemical Classes | Other Classes -> Halogenated Esters |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| 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 |
|---|---|
| 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 |