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26902-76-1

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Basic Information
CAS No.: 26902-76-1
Name: 4'-Ethoxyl-2,2,2-trifluoroacetophenone
Article Data: 2
Molecular Structure:
Molecular Structure of 26902-76-1 (4'-Ethoxyl-2,2,2-trifluoroacetophenone)
Formula: C10H9F3O2
Molecular Weight: 218.17
Synonyms: Acetophenone,4'-ethoxy-2,2,2-trifluoro- (8CI);2,2,2-Trifluoro-4'-ethoxyacetophenone;4'-Ethoxy-a,a,a-trifluoroacetophenone;
Density: 1.226 g/cm3
Boiling Point: 255.2 °C at 760 mmHg
Flash Point: 105 °C
PSA: 26.30000
LogP: 2.83030
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Specification

The CAS register number of 4'-Ethoxyl-2,2,2-trifluoroacetophenone is 26902-76-1. It also can be called as 2,2,2-Trifluoro-4'-ethoxyacetophenone and the systematic name about this chemical is 1-(4-ethoxyphenyl)-2,2,2-trifluoroethanone. The molecular formula about this chemical is C10H9F3O2 and molecular weight is 218.17. It belongs to the Acetylhalide.

Physical properties about 4'-Ethoxyl-2,2,2-trifluoroacetophenone are: (1)ACD/LogP: 2.76; (2)ACD/LogD (pH 5.5): 2.76; (3)ACD/LogD (pH 7.4): 2.76; (4)ACD/BCF (pH 5.5): 73.14; (5)ACD/BCF (pH 7.4): 73.14; (6)ACD/KOC (pH 5.5): 751.55; (7)ACD/KOC (pH 7.4): 751.55; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 26.3Å2; (11)Index of Refraction: 1.452; (12)Molar Refractivity: 48.04 cm3; (13)Molar Volume: 177.8 cm3; (14)Polarizability: 19.04x10-24cm3; (15)Surface Tension: 28.9 dyne/cm; (16)Enthalpy of Vaporization: 49.27 kJ/mol; (17)Boiling Point: 255.2 °C at 760 mmHg; (18)Vapour Pressure: 0.0165 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOc1ccc(cc1)C(=O)C(F)(F)F
(2)InChI: InChI=1/C10H9F3O2/c1-2-15-8-5-3-7(4-6-8)9(14)10(11,12)13/h3-6H,2H2,1H3
(3)InChIKey: JGOGDWNXPIVNSJ-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C10H9F3O2/c1-2-15-8-5-3-7(4-6-8)9(14)10(11,12)13/h3-6H,2H2,1H3
(5)Std. InChIKey: JGOGDWNXPIVNSJ-UHFFFAOYSA-N