ChemicalBook--->CAS DataBase List--->13030-09-6

13030-09-6

13030-09-6 Structure

13030-09-6 Structure
IdentificationMore
[Name]

L-Glutamic acid alpha-benzyl ester
[CAS]

13030-09-6
[Synonyms]

A-BENZYL-L-GLUTAMATE
GLUTAMIC ACID-OBZL
H-GLU-OBZL
L-ALPHA-BENZYL GLUTAMATE
L-GLUTAMIC ACID ALPHA-BENZYL ESTER
1-benzyl l-glutamate
l-glutamic acid 1-benzyl ester
H-L-Glu-OBzl
L-GLUTAMIC ACID-A-BENZYLESTER
L-Glutamic acid hydrogen 1-benzyl ester
H-Glu-OBzl (L-Glutamic acid-benzyl ester)
[Molecular Formula]

C12H15NO4
[MDL Number]

MFCD00037312
[Molecular Weight]

237.25
[MOL File]

13030-09-6.mol
Chemical PropertiesBack Directory
[Melting point ]

157 °C
[Boiling point ]

416.0±40.0 °C(Predicted)
[density ]

1.245±0.06 g/cm3(Predicted)
[storage temp. ]

-15°C
[form ]

powder to crystal
[pka]

4.21±0.10(Predicted)
[color ]

White to Almost white
[InChI]

InChI=1S/C12H15NO4/c13-10(6-7-11(14)15)12(16)17-8-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,14,15)/t10-/m0/s1
[InChIKey]

HFZKKJHBHCZXTQ-JTQLQIEISA-N
[SMILES]

C(OCC1=CC=CC=C1)(=O)[C@H](CCC(O)=O)N
[CAS DataBase Reference]

13030-09-6(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2922.42.5000
[REACH Registrations]

Active
Hazard InformationBack Directory
[Chemical Properties]

White solid
[Uses]

H-Glu-Obzl is a glutamic acid derivative[1].
[Synthesis]

L-Glutamic acid

56-86-0

Benzyl alcohol

100-51-6

gamma-Benzyl L-glutamate

1676-73-9

L-Glutamic acid alpha-benzyl ester

13030-09-6

The general procedure for the synthesis of L-glutamic acid-5-benzyl ester and (S)-4-amino-5-(benzyloxy)-5-oxopentanoic acid from L-glutamic acid and benzyl alcohol was as follows: under typical reaction conditions, 6.8 mmol L-glutamic acid, 10.2 mmol benzyl alcohol (the molar ratio of L-glutamic acid to benzyl alcohol was 1:1.5), and 0.68 mmol CuCl2 were added to a 50 mL single-necked reaction flask. The reaction mixture was stirred at 60 °C for 2 hours. Upon completion of the reaction, the reaction mixture was cooled to room temperature, followed by subsequent analysis.

[References]

[1] Luckose F, et al. Effects of amino acid derivatives on physical, mental, and physiological activities. Crit Rev Food Sci Nutr. 2015;55(13):1793-1144. DOI:10.1080/10408398.2012.708368
Spectrum DetailBack Directory
[Spectrum Detail]

L-Glutamic acid alpha-benzyl ester(13030-09-6)1HNMR
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

1-Benzyl L-Glutamate,>98.0%(LC)(T)(13030-09-6)
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