Product Name

  • Name

    4-(2-chloro-9H-xanthen-9-ylidene)-1-methylpiperidine methanesulfonate (1:1)

  • EINECS
  • CAS No. 60086-22-8
  • Density g/cm3
  • Solubility
  • Melting Point
  • Formula C19H18ClNO•CH4O3S
  • Boiling Point 444.3°Cat760mmHg
  • Molecular Weight 407.94
  • Flash Point 222.5°C
  • Transport Information
  • Appearance
  • Safety Poison by ingestion and intraperitoneal routes. Unspecified human systemic effects by ingestion. When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 60086-22-8 (4-(2-chloro-9H-xanthen-9-ylidene)-1-methylpiperidine methanesulfonate (1:1))
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

Clopipazan mesylate Chemical Properties

IUPAC Name: 4-(2-chloroxanthen-9-ylidene)-1-methylpiperidine ; methanesulfonic acid
Molecular Formula: C20H22ClNO4S
H-Bond Donor: 1
H-Bond Acceptor: 5
Rotatable Bond Count: 0
Exact Mass: 407.095807
MonoIsotopic Mass: 407.095807
SMILES: O=S(=O)(O)C.Clc2cc1C(\c3c(Oc1cc2)cccc3)=C4/CCN(C)CC4
InChI: InChI=1/C19H18ClNO.CH4O3S/c1-21-10-8-13(9-11-21)19-15-4-2-3-5-17(15)22-18-7-6-14(20)12-16(18)19;1-5(2,3)4/h2-7,12H,8-11H2,1H3;1H3,(H,2,3,4)
InChIKey: CPNAKTVMAXLKKO-UHFFFAOYAH
Flash Point: 222.5 °C
Boiling Point: 444.3 °C at 760 mmHg 
Enthalpy of Vaporization: 70.21 kJ/mol
Vapour Pressure: 4.33E-08 mmHg at 25°C 
Structure of Clopipazan mesylate (CAS NO.60086-22-8):

Clopipazan mesylate Toxicity Data With Reference

1.    

orl-hmn TDLo:9140 µg/kg/28D

     DRFUD4    Drugs of the Future. 6 (1981),15.
2.    

orl-rat LD50:319 mg/kg

     DRFUD4    Drugs of the Future. 6 (1981),15.
3.    

ipr-rat LD50:80 mg/kg

     DRFUD4    Drugs of the Future. 6 (1981),15.
4.    

ipr-mus LD50:57 mg/kg

     DRFUD4    Drugs of the Future. 6 (1981),15.

Clopipazan mesylate Safety Profile

Poison by ingestion and intraperitoneal routes. Unspecified human systemic effects by ingestion. When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx.

Clopipazan mesylate Specification

  Clopipazan mesylate , its cas register number is 60086-22-8. It also can be called 4-(2-chloroxanthen-9-ylidene)-1-methylpiperidine and methanesulfonic acid .When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx.

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