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Glycine,2-methoxy-5-nitrophenyl ester, monohydrochloride (9CI)

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Name

Glycine,2-methoxy-5-nitrophenyl ester, monohydrochloride (9CI)

EINECS N/A
CAS No. 153562-56-2 Density 1.357g/cm3
PSA 107.37000 LogP 2.49300
Solubility N/A Melting Point N/A
Formula C9H11ClN2O5 Boiling Point 360.5 °C at 760 mmHg
Molecular Weight 262.647 Flash Point 171.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 153562-56-2 (2-methoxy-5-nitrophenyl glycinate) Hazard Symbols N/A
Synonyms

2-methoxy-5-nitrophenyl glycinate hydrochloride (1:1);2-methoxy-5-nitrophenyl glycinate monohydrochloride;Caged glycine;2-Methoxy-5-nitrophenyl glycine ester;

 

Glycine,2-methoxy-5-nitrophenyl ester, monohydrochloride (9CI) Specification

The Glycine,2-methoxy-5-nitrophenyl ester, monohydrochloride (9CI), with the CAS registry number 153562-56-2, has the systematic name of 2-methoxy-5-nitrophenyl glycinate hydrochloride (1:1). It is also called Caged glycine. And the molecular formula of this chemical is C9H11ClN2O5. What's more, it is a photosensitive blocking group for the carboxyl function of neurotransmitters.

The physical properties of Glycine,2-methoxy-5-nitrophenyl ester, monohydrochloride (9CI) are as following: (1)ACD/LogP: 1.07; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 7; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 84.59 Å2; (7)Flash Point: 171.9 °C; (8)Enthalpy of Vaporization: 60.63 kJ/mol; (9)Boiling Point: 360.5 °C at 760 mmHg; (10)Vapour Pressure: 2.2E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.[O-][N+](=O)c1ccc(OC)c(OC(=O)CN)c1
(2)InChI: InChI=1/C9H10N2O5.ClH/c1-15-7-3-2-6(11(13)14)4-8(7)16-9(12)5-10;/h2-4H,5,10H2,1H3;1H
(3)InChIKey: XHXBDXFPQVJXAF-UHFFFAOYAT

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