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1006-33-3

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Basic Information
CAS No.: 1006-33-3
Name: 2'-BROMO-5'-FLUOROACETOPHENONE
Article Data: 21
Molecular Structure:
Molecular Structure of 1006-33-3 (2'-BROMO-5'-FLUOROACETOPHENONE)
Formula: C8H6 Br F O
Molecular Weight: 217.037
Synonyms: Acetophenone,2'-bromo-5'-fluoro- (7CI,8CI); 1-(2-Bromo-5-fluorophenyl)ethanone;2'-Bromo-5'-fluoroacetophenone
Density: 1.535±0.06 g/cm3(Predicted)
Boiling Point: 144℃/18mm
Flash Point: 105.672oC
PSA: 17.07000
LogP: 2.79080
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Chemistry

Molecular Structure of 2'-Bromo-5'-fluoroacetophenone (CAS NO.1006-33-3):

Systematic Name: 1-(2-Bromo-5-fluorophenyl)ethanone 
Molecular Formula: C8H6BrFO
Molecular Weight: 217.04
CAS Registry Number: 1006-33-3 
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 1
Index of Refraction: 1.534
Molar Refractivity: 43.965 cm3
Molar Volume: 141.358 cm3
Surface Tension: 37.615 dyne/cm
Density: 1.535 g/cm3
Flash Point: 105.672 °C
Enthalpy of Vaporization: 48.841 kJ/mol
Boiling Point: 251.117 °C at 760 mmHg
Vapour Pressure: 0.021 mmHg at 25 °C
SMILES: O=C(C)c1cc(F)ccc1Br
InChI: InChI=1/C8H6BrFO/c1-5(11)7-4-6(10)2-3-8(7)9/h2-4H,1H3
InChIKey: BQXROZQUDCJBBY-UHFFFAOYAT 
Product Categories: Adehydes, Acetals & Ketones; Bromine Compounds; Fluorine Compounds

Specification

 2'-Bromo-5'-fluoroacetophenone (CAS NO.1006-33-3), its Synonyms are Ethanone,1-(2-bromo-5-fluorophenyl)- ; Acetophenone,2'-bromo-5'-fluoro- (7CI,8CI) ; 1-(2-Bromo-5-fluorophenyl)ethanone .