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94444-59-4

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Basic Information
CAS No.: 94444-59-4
Name: 4-Chloro-2-fluorobenzotrifluoride
Article Data: 1
Molecular Structure:
Molecular Structure of 94444-59-4 (4-Chloro-2-fluorobenzotrifluoride)
Formula: C7H3 Cl F4
Molecular Weight: 198.547
Synonyms: 4-Chloro-2-fluoro-1-(trifluoromethyl)benzene;4-Chloro-2-fluorobenzotrifluoride
Density: 1.427g/cm3
Boiling Point: 152°Cat760mmHg
Flash Point: 50.7°C
Hazard Symbols:
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 0.00000
LogP: 3.49790
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Chemistry


Systematic Name: 4-Chloro-2-fluoro-1-(trifluoromethyl)benzene
SMILES: FC(F)(F)c1ccc(Cl)cc1F
InChI: InChI=1/C7H3ClF4/c8-4-1-2-5(6(9)3-4)7(10,11)12/h1-3H
InChIKey: VRVYSPQZUGVNKJ-UHFFFAOYAZ 
Empirical Formula: C7H3ClF4
Molecular Weight: 198.5453
Nominal Mass: 198
Average Mass: 198.5453
Monoisotopic Mass: 197.985941 
Index of Refraction: 1.432
Molar Refractivity: 36.12 cm3
Molar Volume: 139.1 cm3
Surface Tension: 23.8 dyne/cm
Density: 1.427 g/cm3
Flash Point: 50.7 °C
Enthalpy of Vaporization: 37.28 kJ/mol
Boiling Point: 152 °C at 760 mmHg
Vapour Pressure of 4-Chloro-2-fluorobenzotrifluoride (CAS NO.94444-59-4): 4.56 mmHg at 25 °C

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
Hazard Note of 4-Chloro-2-fluorobenzotrifluoride (CAS NO.94444-59-4):  Irritant

Specification

  4-Chloro-2-fluorobenzotrifluoride (CAS NO.94444-59-4), its Synonyms are 4-Chloro-2-fluoro-1-(trifluoromethyl)benzene ; Benzene, 4-chloro-2-fluoro-1-(trifluoromethyl)- .