-
Name
ETHYL 2-(TRIFLUOROMETHYL)BENZOATE
- EINECS
- CAS No. 31083-13-3
- Density 1,459 g/cm3
- Solubility
- Melting Point
- Formula C10H9 F3 O2
- Boiling Point 90-91°C 10mm
- Molecular Weight 218.17
- Flash Point
- Transport Information
- Appearance
- Safety
- Risk Codes R10
-
Molecular Structure
- Hazard Symbols
- Synonyms Aceticacid, trifluoro-, 2-ethylphenyl ester (9CI); Acetic acid, trifluoro-,o-ethylphenyl ester (8CI)
- PSA 26.30000
- LogP 2.88210
Ethyl 2-(trifluoromethyl)benzoate Chemical Properties
Molecule structure of Ethyl 2-(trifluoromethyl)benzoate (CAS NO.31083-13-3) :
IUPAC Name: ethyl 2-(trifluoromethyl)benzoate
Molecular Weight: 218.17247 g/mol
Molecular Formula: C10H9F3O2
Density: 1.23 g/cm3
Boiling Point: 238 °C at 760 mmHg
Flash Point: 83.2 °C
Molar Volume: 177.3 cm3
Polarizability: 18.88*10-24 cm3
Surface Tension: 28.3 dyne/cm
Enthalpy of Vaporization: 47.49 kJ/mol
Vapour Pressure: 0.0434 mmHg at 25 °C
XLogP3: 2
H-Bond Acceptor: 5
Rotatable Bond Count: 3
Exact Mass: 218.055464
MonoIsotopic Mass: 218.055464
Topological Polar Surface Area: 26.3
Heavy Atom Count: 15
Complexity: 225
Canonical SMILES: CCOC(=O)C1=CC=CC=C1C(F)(F)F
InChI: InChI=1S/C10H9F3O2/c1-2-15-9(14)7-5-3-4-6-8(7)10(11,12)13/h3-6H,2H2,1H3
InChIKey of Ethyl 2-(trifluoromethyl)benzoate (CAS NO.31083-13-3) : BQLMZZVRHPZRBQ-UHFFFAOYSA-N
Ethyl 2-(trifluoromethyl)benzoate Safety Profile
Hazard Codes: 
F
Risk Statements: 10
R10: Flammable
Safety Statements: 16
S16: Keep away from sources of ignition
RIDADR: 3272
Ethyl 2-(trifluoromethyl)benzoate Specification
Ethyl 2-(trifluoromethyl)benzoate (CAS NO.31083-13-3) is also called Rarechem al bi 0046 ; 2-(Trifluoromethyl)benzoic acid ethyl ester ; Trifluoroacetic acid 2-ethylphenyl ester .
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