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Basic Information
CAS No.: 691007-06-4
Name: (1Z)-(2,4-Difluorophenyl)-4-piperidinylmethanone oxime acetate
Molecular Structure:
Molecular Structure of 691007-06-4 ((1Z)-(2,4-Difluorophenyl)-4-piperidinylmethanone oxime acetate)
Formula: C12H14F2N2O.C2H4O2
Molecular Weight: 300.30
Synonyms: (1Z)-(2,4-Difluorophenyl)-4-piperidinylmethanone oxime acetate;
Boiling Point: 353.5°C at 760 mmHg
Flash Point: 167.6°C
PSA: 50.69000
LogP: 2.56040
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Chemistry

Molecular Structure of (1Z)-(2,4-Difluorophenyl)-4-piperidinylmethanone oxime acetate (CAS No.691007-06-4):

Molecular Formula: C14H18F2N2O3
Molecular Weight: 300.3011
CAS No: 691007-06-4
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 3
Polar Surface Area: 24.83 Å2
Flash Point: 167.6 °C
Enthalpy of Vaporization: 63.15 kJ/mol
Boiling Point: 353.5 °C at 760 mmHg
Vapour Pressure: 1.32E-05 mmHg at 25°C
InChI: InChI=1/C12H14F2N2O.C2H4O2/c13-9-1-2-10(11(14)7-9)12(16-17)8-3-5-15-6-4-8;1-2(3)4/h1-2,7-8,15,17H,3-6H2;1H3,(H,3,4)/b16-12-;
InChIKey: VGHWWLUDTHOXFN-PXJKFVASBG
Std. InChI: InChI=1S/C12H14F2N2O.C2H4O2/c13-9-1-2-10(11(14)7-9)12(16-17)8-3-5-15-6-4-8;1-2(3)4/h1-2,7-8,15,17H,3-6H2;1H3,(H,3,4)/b16-12-;
Std. InChIKey: VGHWWLUDTHOXFN-PXJKFVASSA-N

Specification

   (1Z)-(2,4-Difluorophenyl)-4-piperidinylmethanone oxime acetate (CAS No.691007-06-4), its synonyms are (Z)-1-(2,4-Difluorophenyl)-N-hydroxy-1-(piperidin-4-yl)methanimine acetate (1:1) ; Methanone, (2,4-difluorophenyl)-4-piperidinyl-, oxime, (Z)-, acetate (1:1) .