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Glycine,N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]-

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Name

Glycine,N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]-

EINECS N/A
CAS No. 207612-92-8 Density 1.542 g/cm3
PSA 115.22000 LogP -1.67950
Solubility N/A Melting Point N/A
Formula C10H12N2O6 Boiling Point 529.892 °C at 760 mmHg
Molecular Weight 256.2121 Flash Point 274.269 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 207612-92-8 (N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]- Glycine) Hazard Symbols N/A
Synonyms

N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]- Glycine

 

Glycine,N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]- Specification

The Glycine,N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]-, with CAS registry number 207612-92-8, has the systematic name of 2-[carboxymethyl-[2-(2,5-dioxopyrrol-1-yl)ethyl]amino]acetic acid. Besides this, it is also called N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]- Glycine. And the chemical formula of this chemical is C10H12N2O6.

Physical properties of Glycine,N-(carboxymethyl)-N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]-: (1)ACD/LogP: 0.45; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 8; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 7; (10)Polar Surface Area: 115.22 Å2; (11)Index of Refraction: 1.597; (12)Molar Refractivity: 56.587 cm3; (13)Molar Volume: 166.171 cm3; (14)Polarizability: 22.433×10-24cm3; (15)Surface Tension: 79.347 dyne/cm; (16)Density: 1.542 g/cm3; (17)Flash Point: 274.269 °C; (18)Enthalpy of Vaporization: 88.069 kJ/mol; (19)Boiling Point: 529.892 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C1=CC(=O)N(C1=O)CCN(CC(=O)O)CC(=O)O
(2)InChI: InChI=1/C10H12N2O6/c13-7-1-2-8(14)12(7)4-3-11(5-9(15)16)6-10(17)18/h1-2H,3-6H2,(H,15,16)(H,17,18)
(3)InChIKey: YXZKLBWQSVZIDK-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C10H12N2O6/c13-7-1-2-8(14)12(7)4-3-11(5-9(15)16)6-10(17)18/h1-2H,3-6H2,(H,15,16)(H,17,18)
(5)Std. InChIKey: YXZKLBWQSVZIDK-UHFFFAOYSA-N

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