Glycine,N-[(phenylmethoxy)carbonyl]-L-leucyl-, methyl ester (9CI) supplier

Name
Z-LEU-GLY-OME
EINECS
CAS No. 5084-98-0
Article Data11
CAS DataBase
Density 1.146 g/cm³
Solubility
Melting Point
Formula C₁₇H₂₄N₂O₅
Boiling Point 516.4 °C at 760 mmHg
Molecular Weight 336.388
Flash Point 266.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Glycine,N-(N-carboxy-L-leucyl)-, N-benzyl methyl ester (7CI,8CI);Glycine,N-[N-[(phenylmethoxy)carbonyl]-L-leucyl]-, methyl ester;NSC 140818;Z-Leu-Gly-OMe;Methyl N-[(benzyloxy)carbonyl]leucylglycinate;
PSA 93.73000
LogP 2.39850

Glycine,N-[(phenylmethoxy)carbonyl]-L-leucyl-, methyl ester (9CI) Specification

The Glycine,N-[(phenylmethoxy)carbonyl]-L-leucyl-, methyl ester (9CI), with the CAS registry number 5084-98-0, has the systematic name of methyl N-[(benzyloxy)carbonyl]leucylglycinate. It should be stored at -15°C. And the molecular formula of the chemical is C₁₇H₂₄N₂O₅.

The characteristics of Glycine,N-[(phenylmethoxy)carbonyl]-L-leucyl-, methyl ester (9CI) are as followings: (1)ACD/LogP: 2.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.64; (4)ACD/LogD (pH 7.4): 2.64; (5)ACD/BCF (pH 5.5): 59.97; (6)ACD/BCF (pH 7.4): 59.94; (7)ACD/KOC (pH 5.5): 652; (8)ACD/KOC (pH 7.4): 651.75; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 76.15 Å²; (13)Index of Refraction: 1.513; (14)Molar Refractivity: 88.18 cm³; (15)Molar Volume: 293.2 cm³; (16)Polarizability: 34.95×10^-24cm³; (17)Surface Tension: 42.1 dyne/cm; (18)Density: 1.146 g/cm³; (19)Flash Point: 266.1 °C; (20)Enthalpy of Vaporization: 78.85 kJ/mol; (21)Boiling Point: 516.4 °C at 760 mmHg; (22)Vapour Pressure: 9.01E-11 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC)CNC(=O)C(NC(=O)OCc1ccccc1)CC(C)C
(2)InChI: InChI=1/C17H24N2O5/c1-12(2)9-14(16(21)18-10-15(20)23-3)19-17(22)24-11-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3,(H,18,21)(H,19,22)
(3)InChIKey: XJNLCCIXRQPNFH-UHFFFAOYAH

Product Name

Z-LEU-GLY-OME

Glycine,N-[(phenylmethoxy)carbonyl]-L-leucyl-, methyl ester (9CI) Specification

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