326-91-0
Product Name:
Thenoyltrifluoroacetone
Formula:
C8H5F3O2S
Synonyms:
4,4,4-Trifluoro-1-(2-thienyl)-1,3-butanedione;TTA (extractant);TTB;TTFA
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | A yellow-tan solid with a weak odor; [MSDSonline] |
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Boiling Point | 96-98 °C at 8.00E+00 mm Hg |
Melting Point | 42 °C |
Vapor Pressure | 0.0069 [mmHg] |
LogP | 1.46 |
Chemical Classes | Other Uses -> Chelating Agents |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 222.19 g/mol |
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XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 3 |
Exact Mass | 221.99623506 g/mol |
Monoisotopic Mass | 221.99623506 g/mol |
Topological Polar Surface Area | 62.4 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 250 |
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 |
PRODUCT INTRODUCTION
description
Thenoyltrifluoroacetone is a chelating agent and inhibitor of cellular respiration.