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L-Glutamic acid diethyl ester hydrochloride

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Name

L-Glutamic acid diethyl ester hydrochloride

EINECS 214-270-4
CAS No. 1118-89-4 Density 1.08g/cm3
PSA 78.62000 LogP 1.72240
Solubility Soluble in water Melting Point 108-110 °C
Formula C9H17NO4.HCl Boiling Point 262 °C at 760 mmHg
Molecular Weight 239.699 Flash Point 86.3 °C
Transport Information N/A Appearance white crystalline powder
Safety 24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 1118-89-4 (Diethyl L-glutamate hydrochloride) Hazard Symbols N/A
Synonyms

Glutamicacid, diethyl ester, hydrochloride, L- (7CI,8CI);L-Glutamic acid, diethylester, hydrochloride (9CI);Diethylglutamate hydrochloride;Glutamic acid diethyl ester hydrochloride;NSC 12960;NSC 17007;Diethyl L-glutamate hydrochloride;

Article Data 11

L-Glutamic acid diethyl ester hydrochloride Synthetic route

56-86-0

L-glutamic acid

75-36-5

acetyl chloride

1118-89-4

diethyl-L-glutamate hydrochloride

Conditions
ConditionsYield
In ethanol at 0℃; for 4h; Reflux;99%
64-17-5

ethanol

56-86-0

L-glutamic acid

1118-89-4

diethyl-L-glutamate hydrochloride

Conditions
ConditionsYield
With thionyl chloride98%
Stage #1: ethanol; L-glutamic acid With bis(trichloromethyl) carbonate at 70 - 75℃; for 5h;
Stage #2: With hydrogenchloride at 20 - 25℃; for 0.5h;
98%
Stage #1: ethanol With thionyl chloride at -10 - 10℃; for 1h;
Stage #2: L-glutamic acid at 20 - 80℃; for 2h;
77.76%
56-86-0

L-glutamic acid

1118-89-4

diethyl-L-glutamate hydrochloride

Conditions
ConditionsYield
at 190 - 195℃; unter vermindertem Druck, Kochen der gebildeten (S)-5-Oxo-pyrrolidin-carbonsaeure-(2) mit aethanol.HCl;
64-17-5

ethanol

1119-33-1

(S)-2-Amino-pentanedioic acid 5-ethyl ester

1118-89-4

diethyl-L-glutamate hydrochloride

Conditions
ConditionsYield
With thionyl chloride at 20℃; for 25h; Cooling with ice;
1118-89-4

diethyl-L-glutamate hydrochloride

2,5-difluoro-4-nitrobenzoyl chloride

7498-31-9

diethyl N-(2,5-difluoro-4-nitrobenzoyl)-L-glutamate

Conditions
ConditionsYield
With triethylamine In dichloromethane for 1h;100%
1118-89-4

diethyl-L-glutamate hydrochloride

(4-Chlorocarbonyl-3,5-difluoro-phenyl)-prop-2-ynyl-carbamic acid tert-butyl ester

141412-75-1

diethyl N-(4-(N-(tert-butyloxycarbonyl)-N-prop-2-ynylamino)-2,6-difluorobenzoyl)-L-glutamate

Conditions
ConditionsYield
With triethylamine In dichloromethane for 2h;100%
1118-89-4

diethyl-L-glutamate hydrochloride

4-(2-amino-4-hydroxy-7H-pyrrolo[2,3-d]pyrimidin-5-ylmethyl)-benzoic acid

150585-92-5

diethyl N-{4-[(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl]benzoyl}-L-glutamate

Conditions
ConditionsYield
With diethyl cyanophosphonate; triethylamine In N,N-dimethyl-formamide at 20℃; for 18h;100%
38239-45-1

5-bromo-3-methyl-thiophene-2-carboxylic acid

1118-89-4

diethyl-L-glutamate hydrochloride

160743-92-0

2(S)-{[(5-bromo-3-methylthiophene-2-yl)carbonyl]amino}pentanedioic acid diethyl ester

Conditions
ConditionsYield
With benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide for 18h;99%
5781-53-3

monomethyl oxalyl chloride

1118-89-4

diethyl-L-glutamate hydrochloride

(S)-2-(methoxyoxalyl-amino)pentanedioic acid diethyl ester

Conditions
ConditionsYield
In toluene99%
1118-89-4

diethyl-L-glutamate hydrochloride

404586-94-3

1-(tert-butoxy)-2-(tert-butoxy)carbonyl-1,2-dihydroisoquinoline

130696-54-7

diethyl (tert-butoxycarbonyl)-L-glutamate

Conditions
ConditionsYield
In diethyl ether Heating;98%

L-Glutamic acid diethyl ester hydrochloride Specification

L-Glutamic acid diethyl ester hydrochloride, with the CAS register number 1118-89-4, could also be known to us as diethylester, hydrochloride,l-glutamicaci; diethyll-glutaminatehydrochloride; l-glutamic acid alpha,gamma-diester hydrochloride; l-glutamic acid alpha, gamma-diethyl ester hydrochloride; glutamic acid(oet)-oet hcl; h-glu(oet)-oet hcl ,etc. It is a white crystalline powder and if you need the safety information, you could refer to the WGK Germany 3 to get some. As for its usage, it is uaually used in the organic synthesis and pharmaceutical intermediates. The product categories of this chemical are as below: glutamic acid [glu, e], amino acids and derivatives, amino acid ethyl esters, biochemistry, amino hydrochloride, glutamic acidneurotransmitters, excitatory amino acids, neurotransmitters, peptide synthesis.

Physical properties about L-Glutamic acid diethyl ester hydrochloride are: (1)#H bond acceptors: 5; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 9; (4)Polar Surface Area: 55.84; (5)Index of Refraction: 1.452; (6)Molar Refractivity: 50.78 cm3; (7)Molar Volume: 188.1 cm3; (8)Polarizability: 20.13 ×10-24cm3; (9)Surface Tension: 37.6 dyne/cm; (10)Density: 1.08 g/cm3; (11)Flash Point: 86.3 °C; (12)Enthalpy of Vaporization: 49.97 kJ/mol; (13)Boiling Point:  262 °C at 760 mmHg; (14)Vapour Pressure: 0.0112 mmHg at 25°C.
 
You can still convert the following datas into molecular structure:
(1)InChI=1S/C9H17NO4.ClH/c1-3-13-8(11)6-5-7(10)9(12)14-4-2;/h7H,3-6,10H2,1-2H3;1H/t7-;/m0./s1;
(2)InChIKey=WSEQLMQNPBNMSL-FJXQXJEOSA-N;
(3)SmilesO(C(=O)[C@H](CCC(OCC)=O)N)CC.Cl

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 246, 1991.

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