Glycine, L-g-glutamyl-S-(2-chloro-4-nitrophenyl)-L-cysteinyl-(9CI) supplier

Name
S-(2-chloro-4-nitrophenyl)-L-cysteinyl-N-L-gamma-glutamylglycine
EINECS
CAS No. 305-60-2
Article Data5
CAS DataBase
Density 1.61 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₉ClN₄O₈S
Boiling Point 731 °C at 760 mmHg
Molecular Weight 462.868
Flash Point 395.9 °C
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Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Glutamine,N-[1-[(carboxymethyl)carbamoyl]-2-[(2-chloro-4-nitrophenyl)thio]ethyl]- (6CI,7CI,8CI);Glycine, N-[S-(2-chloro-4-nitrophenyl)-N-L-g-glutamyl-L-cysteinyl]-;S-(2-Chloro-4-nitrophenyl)glutathione;N-(S-(2-Chloro-4-nitrophenyl)-N-L-gamma-glutamyl- L-cysteinyl)glycine;S-(2-Chloro-4-nitrophenyl)-L-cysteinyl-N-L-γ-glutamylglycine;
PSA
LogP

Glycine, L-g-glutamyl-S-(2-chloro-4-nitrophenyl)-L-cysteinyl-(9CI) Specification

The Glycine, L-g-glutamyl-S-(2-chloro-4-nitrophenyl)-L-cysteinyl-(9CI), with the CAS registry number 305-60-2, is also known as S-(2-Chloro-4-nitrophenyl)glutathione. This chemical's molecular formula is C₁₆H₁₉ClN₄O₈S and molecular weight is 462.86. What's more, its systematic name is S-(2-Chloro-4-nitrophenyl)-L-cysteinyl-N-L-γ-glutamylglycine.

Physical properties of Glycine, L-g-glutamyl-S-(2-chloro-4-nitrophenyl)-L-cysteinyl-(9CI) are: (1)ACD/LogP: 1.66; (2)# of Rule of 5 Violations: 2; (3)#H bond acceptors: 12; (4)#H bond donors: 6; (5)#Freely Rotating Bonds: 13; (6)Polar Surface Area: 167.58 Å²; (7)Index of Refraction: 1.663; (8)Molar Refractivity: 106.55 cm³; (9)Molar Volume: 287.4 cm³; (10)Polarizability: 42.24×10^-24cm³; (11)Surface Tension: 90.8 dyne/cm; (12)Density: 1.61 g/cm³; (13)Flash Point: 395.9 °C; (14)Enthalpy of Vaporization: 112 kJ/mol; (15)Boiling Point: 731 °C at 760 mmHg; (16)Vapour Pressure: 1.96E-22 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(ccc1SC[C@@H](C(=O)N(C(=O)CC[C@@H](C(=O)O)N)CC(=O)O)N)[N+]([O-])=O
(2)InChI: InChI=1S/C16H19ClN4O8S/c17-9-5-8(21(28)29)1-3-12(9)30-7-11(19)15(25)20(6-14(23)24)13(22)4-2-10(18)16(26)27/h1,3,5,10-11H,2,4,6-7,18-19H2,(H,23,24)(H,26,27)/t10-,11-/m0/s1
(3)InChIKey: OSGIWCVVJPJIHM-QWRGUYRKSA-N

Product Name

S-(2-chloro-4-nitrophenyl)-L-cysteinyl-N-L-gamma-glutamylglycine

Glycine, L-g-glutamyl-S-(2-chloro-4-nitrophenyl)-L-cysteinyl-(9CI) Specification

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