L-Glutamic acid alpha-benzyl ester supplier

Name
L-Glutamic acid alpha-benzyl ester
EINECS
CAS No. 13030-09-6
Article Data4
CAS DataBase
Density 1.245 g/cm³
Solubility
Melting Point 157 °C
Formula C₁₂H₁₅NO₄
Boiling Point 416 °C at 760 mmHg
Molecular Weight 237.255
Flash Point 205.4 °C
Transport Information
Appearance
Safety
Risk Codes R36/37/38; R42; R42/43; R23/24/25
Molecular Structure
Hazard Symbols Xn,T
Synonyms H-Glu-OBzl;Glutamicacid, 1-benzyl ester (6CI);Glutamic acid, 1-benzyl ester, L- (7CI,8CI);Glutamic acid a-benzylester;L-Glutamic acid a-benzyl ester;a-Benzyl L-glutamate;
PSA 89.62000
LogP 1.62220

L-Glutamic acid alpha-benzyl ester Specification

The L-Glutamic acid,1-(phenylmethyl) ester, with the CAS registry number 13030-09-6, is also known as H-Glu-OBzl. It belongs to the product categories of Amino Acid Derivatives; Amino Acids; Glutamic Acid [Glu, E]; Amino Acids and Derivatives; Amino Acid Benzyl Esters; Amino Acids (C-Protected); Biochemistry; Amino Acid Derivatives. This chemical's molecular formula is C₁₂H₁₅NO₄ and molecular weight is 237.25. What's more, its systematic name is called (4S)-4-Ammonio-5-(benzyloxy)-5-oxopentanoate.

Physical properties about L-Glutamic acid,1-(phenylmethyl) ester are: (1) ACD/LogP: 1.33; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): -1.11; (4) ACD/LogD (pH 7.4): -1.18; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 1; (8) ACD/KOC (pH 7.4): 1; (9) #H bond acceptors: 5; (10) #H bond donors: 3; (11) #Freely Rotating Bonds: 8; (12) Polar Surface Area: 63.6 Å²; (13) Index of Refraction: 1.555; (14) Molar Refractivity: 61.16 cm³; (15) Molar Volume: 190.4 cm³; (16) Surface Tension: 53.8 dyne/cm; (17) Density: 1.245 g/cm³; (18) Flash Point: 205.4 °C; (19) Enthalpy of Vaporization: 70.56 kJ/mol; (20) Boiling Point: 416 °C at 760 mmHg; (21) Vapour Pressure: 1.15E-07 mmHg at 25°C; (22) Melting Point: 157°C.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-]C(=O)CC[C@@H](C(=O)OCc1ccccc1)[NH3+]
(2) InChI: InChI=1/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
(3) InChIKey: HFZKKJHBHCZXTQ-JTQLQIEIBD

Product Name

L-Glutamic acid alpha-benzyl ester

L-Glutamic acid alpha-benzyl ester Specification

Related Products

Hot Products