Product Name

  • Name

    2-{[1-(2-chlorophenoxy)propan-2-yl](methyl)amino}-N,N-diethyl-2-oxoethanaminium chloride

  • EINECS
  • CAS No. 102585-43-3
  • Density
  • Solubility
  • Melting Point
  • Formula C16H25 Cl N2 O2 . Cl H
  • Boiling Point 418.7°C at 760 mmHg
  • Molecular Weight 349.34
  • Flash Point 207°C
  • Transport Information
  • Appearance
  • Safety Poison by subcutaneous route. An eye irritant. When heated to decomposition it emits very toxic fumes of Cl− and NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 102585-43-3 (2-{[1-(2-chlorophenoxy)propan-2-yl](methyl)amino}-N,N-diethyl-2-oxoethanaminium chloride)
  • Hazard Symbols
  • Synonyms Acetamide,N-[2-(2-chlorophenoxy)-1-methylethyl]-2-(diethylamino)-N-methyl-,monohydrochloride (9CI)
  • PSA
  • LogP

N-(1-(o-Chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methylacetamide hydrochloride Chemical Properties

Molecule structure of N-(1-(o-Chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methylacetamide hydrochloride (CAS NO.102585-43-3):

IUPAC Name: [2-[1-(2-Chlorophenoxy)propan-2-yl-methylamino]-2-oxoethyl]-diethylazanium chloride 
Molecular Weight: 349.29584 g/mol
Molecular Formula: C16H26Cl2N2O2 
Boiling Point: 418.7 °C at 760 mmHg
Flash Point: 207 °C
Enthalpy of Vaporization: 67.23 kJ/mol
Vapour Pressure: 3.21E-07 mmHg at 25 °C
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 8
Exact Mass: 348.137134
MonoIsotopic Mass: 348.137134
Topological Polar Surface Area: 34
Heavy Atom Count: 22
Complexity: 311
Canonical SMILES: CC[NH+](CC)CC(=O)N(C)C(C)COC1=CC=CC=C1Cl.[Cl-]
InChI: InChI=1S/C16H25ClN2O2.ClH/c1-5-19(6-2)11-16(20)18(4)13(3)12-21-15-10-8-7-9-14(15)17;/h7-10,13H,5-6,11-12H2,1-4H3;1H
InChIKey of N-(1-(o-Chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methylacetamide hydrochloride (CAS NO.102585-43-3): CTPNAMKZKVMVNZ-UHFFFAOYSA-N

N-(1-(o-Chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methylacetamide hydrochloride Toxicity Data With Reference

1.    

eye-rbt 2% MLD

     ARZNAD    Arzneimittel-Forschung. Drug Research. 9 (1959),70.
2.    

scu-mus LD50:330 mg/kg

     ARZNAD    Arzneimittel-Forschung. Drug Research. 9 (1959),70.

N-(1-(o-Chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methylacetamide hydrochloride Safety Profile

Poison by subcutaneous route. An eye irritant. When heated to decomposition it emits very toxic fumes of Cl− and NOx.

N-(1-(o-Chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methylacetamide hydrochloride Specification

 N-(1-(o-Chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methylacetamide hydrochloride (CAS NO.102585-43-3) is also named as C 2095 ; Acetamide, N-(1-(o-chlorophenoxy)-2-propyl)-2-(diethylamino)-N-methyl-, hydrochloride .

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