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59749-44-9

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Basic Information
CAS No.: 59749-44-9
Name: 2-(dimethylamino)ethyl 1-(4-chlorobenzyl)-5-oxo-L-prolinate (2E)-but-2-enedioate
Molecular Structure:
Molecular Structure of 59749-44-9 (2-(dimethylamino)ethyl 1-(4-chlorobenzyl)-5-oxo-L-prolinate (2E)-but-2-enedioate)
Formula: C16H21ClN2O3•C4H4O4
Molecular Weight: 440.92
Boiling Point: 475°C at 760 mmHg
Flash Point: 241.1°C
Safety: Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx and Cl−.
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Chemistry

Product Name: L-Proline, 1-((4-chlorophenyl)methyl)-5-oxo-, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)
CAS Registry Number: 59749-44-9
IUPAC Name: (E)-but-2-enedioic acid; 2-dimethylaminoethyl (2S)-1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate
Molecular Weight: 440.8747 [g/mol]
Molecular Formula: C20H25ClN2O7
H-Bond Donor: 2
H-Bond Acceptor: 8
Flash Point: 241.1 °C
Enthalpy of Vaporization: 73.84 kJ/mol
Boiling Point: 475 °C at 760 mmHg
Vapour Pressure: 3.44E-09 mmHg at 25°C
Following is the molecular structure of L-Proline, 1-((4-chlorophenyl)methyl)-5-oxo-, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) (CAS NO.59749-44-9) is:

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1200mg/kg (1200mg/kg)   French Demande Patent Document. Vol. #2273533,

Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx and Cl−.

Specification

 L-Proline, 1-((4-chlorophenyl)methyl)-5-oxo-, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) , its cas register number is 59749-44-9. It also can be called Maleate de N-(p-chlorobenzyl)pyroglutamate de dimethylaminoethyle ; Maleate de N-(p-chlorobenzyl)pyroglutamate de dimethylaminoethyle [French] .