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Basic Information
CAS No.: 61747-22-6
Name: 1-Pentanone-5-methoxy-1-[4-(trifluoromethyl)phenyl]-oxime
Molecular Structure:
Molecular Structure of 61747-22-6 (1-Pentanone-5-methoxy-1-[4-(trifluoromethyl)phenyl]-oxime)
Formula: C13H16 F3 N O2
Molecular Weight: 275.271
Synonyms: 5-methoxy-4'-trifluoromethylvalerophenone oxime
Density: 1.17 g/cm3
Boiling Point: 338 ºC
Flash Point: 158 ºC
PSA: 41.82000
LogP: 3.70040
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Specification

     The 1-Pentanone-5-methoxy-1-[4-(trifluoromethyl)phenyl]-oxime , with the CAS register number 61747-22-6, is also known as 1-pentanone-5-methoxy-1-[4-(trifluoromethyl)phenyl]-oxime ,5-methoxy-1-[4-(trifluoromethyl)phenyl]-1-pentanone oxime , and so on.

    Properties of 1-Pentanone-5-methoxy-1-[4-(trifluoromethyl)phenyl]-oxime are as following: (1)H bond acceptors: 3 ; (2)H bond donors: 1 ; (3)Freely Rotating Bonds: 7 ; (4)Polar Surface Area: 41.82 ; (5)Index of Refraction: 1.466 ; (5)Molar Refractivity: 65.16 cm3 ; (6)Molar Volume: 235.1 cm3 ; (7)Polarizability: 25.83 10-24cm3 ; (8)Surface Tension: 30.8 dyne/cm ; (9)Enthalpy of Vaporization: 61.34 kJ/mol ; (10)Vapour Pressure: 3.97E-05 mmHg at 25°C. 

    This kind of chemical belongs to the category of Aromatics, and Nitric Oxide Reagents. Generally, it is usually used in pharmaceuticals, organic raw materials, fluvoxamine intermediate, and medical intermediate.

    You could find the chemical molecular structure by using converting the following data information:
SMILES:
COCCCCC(=NO)c1ccc(cc1)C(F)(F)
InChI:
InChI=1/C13H16F3NO2/c1-19-9-3-2-4-12(17-18)10-5-7-11(8-6-10)13(14,15)16/h5-8,18H,2-4,9H2,1H3