Cbz-L-Glutamic acid 1-benzyl ester supplier

Name
L-Glutamic acid,N-[(phenylmethoxy)carbonyl]-, 1-(phenylmethyl) ester
EINECS 2017-001-1
CAS No. 3705-42-8
Article Data10
CAS DataBase
Density 1.268 g/cm³
Solubility Soluble in methanol, dimethyl sulfoxide. Slightly soluble in water.
Melting Point 92-93?C
Formula C₂₀H₂₁NO₆
Boiling Point 594.3 °C at 760 mmHg
Molecular Weight 371.39
Flash Point 313.2 °C
Transport Information
Appearance White to off-white microcrystalline powder
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Glutamicacid, N-carboxy-, N,1-dibenzyl ester (7CI);Glutamic acid, N-carboxy-,N,1-dibenzyl ester, L- (8CI);N-(Benzyloxycarbonyl)-L-glutamic acid a-monobenzyl ester;N-(Benzyloxycarbonyl)glutamic acid a-benzyl ester;N-Benzyloxycarbonyl-L-glutamic acid 1-benzyl ester;N-Carbobenzoxy-L-glutamic acid a-benzyl ester;NSC 169160;a-Benzyl N-(benzyloxycarbonyl)-L-glutamate;Z-Glu-OBzl;
PSA 101.93000
LogP 3.28050

Cbz-L-Glutamic acid 1-benzyl ester Specification

The L-Glutamic acid,N-[(phenylmethoxy)carbonyl]-, 1-(phenylmethyl) ester, with the CAS registry number 3705-42-8, is also known as Cbz-L-Glu-OBzl and N-Benzyloxycarbonyl-L-glutamic acid 1-benzyl ester. It belongs to the product categories of Amino Acid Derivatives; Z-Amino Acids and Derivatives; Z-Amino Acid Series. This chemical's molecular formula is C₂₀H₂₁NO₆ and molecular weight is 371.38. What's more, its IUPAC name is 5-Oxo-5-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanoic acid and systematic name is called (4S)-5-(Benzyloxy)-4-{[(benzyloxy)carbonyl]amino}-5-oxopentanoic acid. This chemical can be used as a new glutamate analogue as potential neuroprotective agent. In addition, it is white to off-white microcrystalline powder.

Physical properties about L-Glutamic acid,N-[(phenylmethoxy)carbonyl]-, 1-(phenylmethyl) ester are: (1) ACD/LogP: 4.05; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 2.94; (4) ACD/LogD (pH 7.4): 1.14; (5) ACD/BCF (pH 5.5): 54.12; (6) ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 292.34; (8) ACD/KOC (pH 7.4): 4.65; (9) #H bond acceptors: 7; (10) #H bond donors: 2; (11) #Freely Rotating Bonds: 11; (12) Polar Surface Area: 82.14 Å²; (13) Index of Refraction: 1.575; (14) Molar Refractivity: 96.75 cm³; (15) Molar Volume: 292.7 cm³; (16)Surface Tension: 53.3 dyne/cm; (17) Density: 1.268 g/cm³; (18) Flash Point: 313.2 °C; (19) Enthalpy of Vaporization: 93.16 kJ/mol; (20) Boiling Point: 594.3 °C at 760 mmHg; (21) Vapour Pressure: 5.72E-15 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCc1ccccc1)[C@@H](NC(=O)OCc2ccccc2)CCC(=O)O
(2) InChI: InChI=1/C20H21NO6/c22-18(23)12-11-17(19(24)26-13-15-7-3-1-4-8-15)21-20(25)27-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,21,25)(H,22,23)/t17-/m0/s1
(3) InChIKey: VWHKODOUMSMUAF-KRWDZBQOBG

Product Name

L-Glutamic acid,N-[(phenylmethoxy)carbonyl]-, 1-(phenylmethyl) ester

Cbz-L-Glutamic acid 1-benzyl ester Specification

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