Product Name

  • Name

    4-(p-Chlorophenyl)-1-piperazinyl(3,4,5-trimethoxyphenyl) ketone

  • EINECS
  • CAS No. 17766-66-4
  • Article Data1
  • CAS DataBase
  • Density 1.245g/cm3
  • Solubility
  • Melting Point
  • Formula C20H23ClN2O4
  • Boiling Point 579.5°Cat760mmHg
  • Molecular Weight 390.90
  • Flash Point 304.3°C
  • Transport Information
  • Appearance
  • Safety A poison by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of NOx and Cl−.
  • Risk Codes
  • Molecular Structure Molecular Structure of 17766-66-4 (4-(p-Chlorophenyl)-1-piperazinyl(3,4,5-trimethoxyphenyl) ketone)
  • Hazard Symbols
  • Synonyms
  • PSA 51.24000
  • LogP 3.33110

Ketone, 4-(p-chlorophenyl)piperazinyl 3,4,5-trimethoxyphenyl Chemical Properties

The Molecular Structure of  Ketone, 4-(p-chlorophenyl)piperazinyl 3,4,5-trimethoxyphenyl (CAS NO.17766-66-4):
Molecular Formula: C20H23ClN2O4
Molecular Weight: 390.860620 g/mol
IUPAC: [4-(4-chlorophenyl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
Index of Refraction: 1.581
Molar Refractivity: 104.59 cm3
Molar Volume: 313.7 cm3
Surface Tension: 46.4 dyne/cm
Density: 1.245 g/cm3
Flash Point: 304.3 °C
Enthalpy of Vaporization: 86.71 kJ/mol
Boiling Point: 579.5 °C at 760 mmHg
Vapour Pressure: 2E-13 mmHg at 25°C
InChI
InChI=1/C20H23ClN2O4/c1-25-17-12-14(13-18(26-2)19(17)27-3)20(24)23-10-8-22(9-11-23)16-6-4-15(21)5-7-16/h4-7,12-13H,8-11H2,1-3H3
Smiles
c1(cc(c(OC)c(c1)OC)OC)C(N1CCN(c2ccc(Cl)cc2)CC1)=O

Ketone, 4-(p-chlorophenyl)piperazinyl 3,4,5-trimethoxyphenyl Toxicity Data With Reference

1.    

ipr-mus LD50:300 mg/kg

     JMCMAR    Journal of Medicinal Chemistry. 11 (1968),332.

Ketone, 4-(p-chlorophenyl)piperazinyl 3,4,5-trimethoxyphenyl Safety Profile

A poison by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of NOx and Cl−.

Ketone, 4-(p-chlorophenyl)piperazinyl 3,4,5-trimethoxyphenyl Standards and Recommendations

DOT Classification:  3; Label: Flammable Liquid

Ketone, 4-(p-chlorophenyl)piperazinyl 3,4,5-trimethoxyphenyl Specification

 Ketone, 4-(p-chlorophenyl)piperazinyl 3,4,5-trimethoxyphenyl (CAS NO.17766-66-4) is also called as 1-(p-Chlorophenyl)-4-(3,4,5-trimethoxybenzoyl)piperazine ; 4-(p-Chlorophenyl)piperazinyl 3,4,5-trimethyoxyphenyl ketone ; 5-23-01-00179 (Beilstein Handbook Reference) ; BRN 1603839 ; Piperazine, 1-(p-chlorophenyl)-4-(3,4,5-trimethoxybenzoyl)- .

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