Product Name

  • Name

    1-(2-methoxyphenyl)-4-(3,4,5-trimethoxybenzoyl)piperazine

  • EINECS
  • CAS No. 17766-68-6
  • Density 1.186g/cm3
  • Solubility
  • Melting Point
  • Formula C21H26N2O5
  • Boiling Point 578.3°Cat760mmHg
  • Molecular Weight 386.49
  • Flash Point 303.5°C
  • Transport Information
  • Appearance
  • Safety A poison by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 17766-68-6 (1-(2-methoxyphenyl)-4-(3,4,5-trimethoxybenzoyl)piperazine)
  • Hazard Symbols
  • Synonyms
  • PSA 60.47000
  • LogP 2.68630

4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone Chemical Properties

The Molecular Structure of 4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone (CAS NO.17766-68-6):

Molecular Formula: C21H26N2O5
Molecular Weight: 386.441540 g/mol
IUPAC: [4-(2-methoxyphenyl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
Index of Refraction: 1.566
Molar Refractivity: 106.38 cm3
Molar Volume: 325.7 cm3
Surface Tension: 44.3 dyne/cm
Density: 1.186 g/cm3
Flash Point: 303.5 °C
Enthalpy of Vaporization: 86.55 kJ/mol
Boiling Point: 578.3 °C at 760 mmHg
Vapour Pressure: 2.27E-13 mmHg at 25°C 
InChI
InChI=1/C21H26N2O5/c1-25-17-8-6-5-7-16(17)22-9-11-23(12-10-22)21(24)15-13-18(26-2)20(28-4)19(14-15)27-3/h5-8,13-14H,9-12H2,1-4H3 Smiles
c1(N2CCN(C(c3cc(c(OC)c(c3)OC)OC)=O)CC2)c(cccc1)OC 
Classification Code:  classified as Drug / Therapeutic Agent

4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone Toxicity Data With Reference

1.    

ipr-mus LD50:75 mg/kg

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

4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone Safety Profile

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

4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone Standards and Recommendations

DOT Classification:  3; Label: Flammable Liquid

4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone Specification

 4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone (CAS NO.17766-68-6) is also called as 1-(o-Methoxyphenyl)-4-(3,4,5-trimethoxybenzoyl)piperazine ; 5-23-02-00004 (Beilstein Handbook Reference) ; BRN 1605432 ; Piperazine, 1-(o-methoxyphenyl)-4-(3,4,5-trimethoxybenzoyl)- ; Ketone, 4-(o-methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl .

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