(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone supplier

Name
5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-one
EINECS
CAS No. 101931-68-4
Density 1.391g/cm³
Solubility
Melting Point
Formula C12H10 F6 O2
Boiling Point 319.5°Cat760mmHg
Molecular Weight 300.22
Flash Point 147°C
Transport Information
Appearance
Safety A poison by intravenous route. A flammable liquid. When heated to decomposition it emits toxic vapors of F⁻.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms NSC 168576
PSA
LogP

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Chemical Properties

Molecular Structure of (3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone (CAS NO. 101931-68-4):

IUPAC Name: 5,5,5-Trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-one
Molecular Formula: C₁₂H₁₀F₆O₂
Molecular Weight: 300.197019 g/mol
XLogP3-AA: 2.9
H-Bond Donor: 1
H-Bond Acceptor: 8
Canonical SMILES: C1=CC=C(C=C1)CC(=O)CC(C(F)(F)F)(C(F)(F)F)O
InChI: InChI=1S/C12H10F6O2/c13-11(14,15)10(20,12(16,17)18)7-9(19)6-8-4-2-1-3-5-8/h1-5,20H,6-7H2
InChIKey: HUAFVTMSVNQVEQ-UHFFFAOYSA-N
Index of Refraction: 1.439
Molar Refractivity: 56.77 cm³
Molar Volume: 215.7 cm³
Surface Tension: 30.5 dyne/cm
Density: 1.391 g/cm³
Flash Point: 147 °C
Enthalpy of Vaporization: 59.24 kJ/mol
Boiling Point: 319.5 °C at 760 mmHg
Vapour Pressure of (3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone (CAS NO. 101931-68-4): 0.00014 mmHg at 25 °C

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Toxicity Data With Reference

ivn-mus LD50:100 mg/kg

CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) NX#09216 .

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Safety Profile

A poison by intravenous route. A flammable liquid. When heated to decomposition it emits toxic vapors of F⁻.

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Standards and Recommendations

DOT Classification: 3; Label: Flammable Liquid

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Specification

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone with cas registry number of 101931-68-4 is also called for 2-Pentanone, 4-hydroxy-1-phenyl-5,5,5-trifluoro-4-(trifluoromethyl)- .

Product Name

5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-one

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Chemical Properties

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Toxicity Data With Reference

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Safety Profile

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Standards and Recommendations

(3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl))propyl benzyl ketone Specification

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