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1-Imidazolidineacetic acid, -alpha-,4-dimethyl-2,5-dioxo-

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Name

1-Imidazolidineacetic acid, -alpha-,4-dimethyl-2,5-dioxo-

EINECS N/A
CAS No. 556080-37-6 Density 1.184 g/cm3
PSA 90.20000 LogP -1.02230
Solubility N/A Melting Point N/A
Formula C9H14N2O4 Boiling Point N/A
Molecular Weight 186.167 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 556080-37-6 (1-Imidazolidineacetic  acid,  -alpha-,4-dimethyl-2,5-dioxo-) Hazard Symbols N/A
Synonyms

ethyl 2-(4-methyl-2,5-dioxoimidazolidin-4-yl)propanoate;

 

1-Imidazolidineacetic acid, -alpha-,4-dimethyl-2,5-dioxo- Specification

The 1-Imidazolidineacetic  acid,  -alpha-,4-dimethyl-2,5-dioxo- is an organic compound with the formula C9H14N2O4. The systematic name of this chemical is ethyl 2-(4-methyl-2,5-dioxoimidazolidin-4-yl)propanoate. With the CAS registry number 556080-37-6, it is also named as 4-Imidazolidineacetic acid, α,4-dimethyl-2,5-dioxo-, ethyl ester.

Physical properties about 1-Imidazolidineacetic  acid,  -alpha-,4-dimethyl-2,5-dioxo- are: (1)ACD/LogP: 0.06 ; (2)ACD/LogD (pH 5.5): 0.06; (3)ACD/LogD (pH 7.4): 0.05; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 25.69; (7)ACD/KOC (pH 7.4): 25.21; (8)#H bond acceptors: 6; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 66.92 Å2; (12)Index of Refraction: 1.468; (13)Molar Refractivity: 50.31 cm3; (14)Molar Volume: 180.8 cm3; (15)Polarizability: 19.94×10-24cm3; (16)Surface Tension: 37.5 dyne/cm; (17)Density: 1.184 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)NC1(C(C(=O)OCC)C)C
(2)InChI: InChI=1/C9H14N2O4/c1-4-15-6(12)5(2)9(3)7(13)10-8(14)11-9/h5H,4H2,1-3H3,(H2,10,11,13,14)
(3)InChIKey: NPRQVWZNMLUZIN-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C9H14N2O4/c1-4-15-6(12)5(2)9(3)7(13)10-8(14)11-9/h5H,4H2,1-3H3,(H2,10,11,13,14)
(5)Std. InChIKey: NPRQVWZNMLUZIN-UHFFFAOYSA-N

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