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2014-32-6

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Basic Information
CAS No.: 2014-32-6
Name: N,N-diethyl-2-oxo-2-(2,4,6-trimethylphenoxy)ethanaminium chloride
Molecular Structure:
Molecular Structure of 2014-32-6 (N,N-diethyl-2-oxo-2-(2,4,6-trimethylphenoxy)ethanaminium chloride)
Formula: C15H23NO2•ClH
Molecular Weight: 285.85
Density: g/cm3
Boiling Point: 330°Cat760mmHg
Flash Point: 107.3°C
Safety: Moderately toxic by subcutaneous route. An eye and skin irritant. When heated to decomposition it emits toxic fumes of NOx and HCl. See also ESTERS.
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Chemistry

Structure of FC 657 (CAS NO.2014-32-6):

Empirical Formula: C15H24ClNO2
Molecular Weight: 285.8096 g/mol
Flash Point: 107.3 °C
Enthalpy of Vaporization: 57.25 kJ/mol
Boiling Point: 330 °C at 760 mmHg
Vapour Pressure: 0.000171 mmHg at 25 °C 
IUPAC Name: Diethyl-[2-oxo-2-(2,4,6-trimethylphenoxy)ethyl]azanium chloride
Canonical SMILES: CC[NH+](CC)CC(=O)OC1=C(C=C(C=C1C)C)C.[Cl-]
InChI: InChI=1S/C15H23NO2.ClH/c1-6-16(7-2)10-14(17)18-15-12(4)8-11(3)9-13(15)5;/h8-9H,6-7,10H2,1-5H3;1H
InChIKey: OCEPJLPTHYPDJB-UHFFFAOYSA-N
Classification Code: Drug / Therapeutic Agent ; Skin / Eye Irritant

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 2gm/kg (2000mg/kg)   Bollettino Chimico Farmaceutico. Vol. 107, Pg. 310, 1968.

Safety Profile

Moderately toxic by subcutaneous route. An eye and skin irritant. When heated to decomposition FC 657 (CAS NO.2014-32-6) emits toxic fumes of NOx and HCl. See also ESTERS.

Specification

 FC 657 ,its cas register number is 2014-32-6. It also can be called Glycine, N,N-diethyl-, mesityl ester, hydrochloride ; and N,N-Diethylglycine mesityl ester hydrochloride .