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164329-39-9
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Basic Information
CAS No.: 164329-39-9
Name: 2-(2-ethoxyacetyl)-1,8-dimethylimidazo[1,2-a]quinoxalin-4(5H)-one
Molecular Structure:
Molecular Structure of 164329-39-9 (2-(2-ethoxyacetyl)-1,8-dimethylimidazo[1,2-a]quinoxalin-4(5H)-one)
Formula: C15H15N3O3
Molecular Weight: 285.30
Synonyms: 2-(Ethoxy;2-(ethoxy;imidazo[1;LogP
Density: 1.377 g/cm3
PSA: 76.46000
LogP: 2.01180
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Specification

The Imidazo[1,2-a]quinoxaline-2-carboxylicacid, 4,5-dihydro-1,8-dimethyl-4-oxo-, ethyl ester has CAS registry number 164329-39-9. This chemical's molecular formula is C15H15N3O3 and molecular weight is 285.30. What's more, its systematic name is ethyl 1,8-dimethyl-4-oxo-5H-imidazo[1,2-a]quinoxaline-2-carboxylate.

Physical properties of Imidazo[1,2-a]quinoxaline-2-carboxylicacid, 4,5-dihydro-1,8-dimethyl-4-oxo-, ethyl ester are: (1)ACD/LogP: 3.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.773; (4)ACD/LogD (pH 7.4): 3.773; (5)ACD/BCF (pH 5.5): 434.051; (6)ACD/BCF (pH 7.4): 434.025; (7)ACD/KOC (pH 5.5): 2688.778; (8)ACD/KOC (pH 7.4): 2688.619; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 73.22 Å2; (13)Index of Refraction: 1.661; (14)Molar Refractivity: 76.628 cm3; (15)Molar Volume: 207.226 cm3; (16)Polarizability: 30.378×10-24cm3; (17)Surface Tension: 49.88 dyne/cm; (18)Density: 1.377 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOC(=O)c1c(n2c3cc(ccc3[nH]c(=O)c2n1)C)C
(2)Std. InChI: InChI=1S/C15H15N3O3/c1-4-21-15(20)12-9(3)18-11-7-8(2)5-6-10(11)16-14(19)13(18)17-12/h5-7H,4H2,1-3H3,(H,16,19
(3)Std. InChIKey: BVPLEJDDLMHQKI-UHFFFAOYSA-N