Product Name

  • Name

    2,6-di(propan-2-yl)phenyl 2-(4-methylpiperazin-1-yl)propanoate dihydrochloride

  • EINECS
  • CAS No. 1877-53-8
  • Density
  • Solubility
  • Melting Point
  • Formula C20H32N2O2•2ClH
  • Boiling Point 400°C at 760 mmHg
  • Molecular Weight 405.46
  • Flash Point 195.7°C
  • Transport Information
  • Appearance
  • Safety Poison by intravenous route. Moderately toxic by subcutaneous route. A severe eye and skin irritant. When heated to decomposition it emits toxic fumes of NOx and HCl. See also ESTERS.
  • Risk Codes
  • Molecular Structure Molecular Structure of 1877-53-8 (2,6-di(propan-2-yl)phenyl 2-(4-methylpiperazin-1-yl)propanoate dihydrochloride)
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

FC 646 Chemical Properties

Empirical Formula of FC 646 (CAS NO.1877-53-8): C20H34Cl2N2O2
Molecular Weight: 405.4022 g/mol
Flash Point: 195.7 °C
Enthalpy of Vaporization: 65.08 kJ/mol
Boiling Point: 400 °C at 760 mmHg
Vapour Pressure: 1.31E-06 mmHg at 25 °C
Structure of FC 646 (CAS NO.1877-53-8):
            
IUPAC Name: [2,6-Di(propan-2-yl)phenyl] 2-(4-methylpiperazin-1-yl)propanoatedihydrochloride
Canonical SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)C(C)N2CCN(CC2)C.Cl.Cl
InChI: InChI=1S/C20H32N2O2.2ClH/c1-14(2)17-8-7-9-18(15(3)4)19(17)24-20(23)16(5)22-12-10-21(6)11-13-22;;/h7-9,14-16H,10-13H2,1-6H3;2*1H
InChIKey: WCUBZRWENCBUQL-UHFFFAOYSA-N

FC 646 Toxicity Data With Reference

1.    

skn-rbt 200 mg SEV

    BCFAAI    Bollettino Chimico Farmaceutico. 107 (1968),310.
2.    

eye-rbt 1 g SEV

    BCFAAI    Bollettino Chimico Farmaceutico. 107 (1968),310.
3.    

scu-mus LD50:600 mg/kg

    BCFAAI    Bollettino Chimico Farmaceutico. 107 (1968),310.
4.    

ivn-mus LD50:42 mg/kg

    BCFAAI    Bollettino Chimico Farmaceutico. 107 (1968),310.

FC 646 Safety Profile

Poison by intravenous route. Moderately toxic by subcutaneous route. A severe eye and skin irritant. When heated to decomposition FC 646 (CAS NO.1877-53-8) emits toxic fumes of NOx and HCl. See also ESTERS.

FC 646 Specification

 FC 646 ,its cas register number is 1877-53-8. It also can be called 1-Piperazineacetic acid, alpha,4-dimethyl-, 2,6-
diisopropylphenyl ester, dihydrochloride ; and alpha,4-Dimethyl-1-piperazineacetic acid 2,6-diisopropylphenyl ester dihydrochloride .

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