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Sodium 5-ethyl-5-(4-methyl-2-hexanyl)-4,6-dioxo-1,4,5,6-tetrahydro-2-pyrimidinolate

ChemSpider ID: 44079
Molecular Formula: C₁₃H₂₁N₂NaO₃
Average mass: 276.30719 Da
Monoisotopic mass: 276.144989 Da
Systematic name

Sodium 5-ethyl-5-(4-methyl-2-hexanyl)-4,6-dioxo-1,4,5,6-tetrahydro-2-pyrimidinolate
SMILES and InChIs

SMILES:

[Na+].O=C1/N=C(/[O-])NC(=O)C1(C(CC(C)CC)C)CC Copied

Std. InChI:

InChI=1S/C13H22N2O3.Na/c1-5-8(3)7-9(4)13(6-2)10(16)14-12(18)15-11(13)17;/h8-9H,5-7H2,1-4H3,(H2,14,15,16,17,18);/q;+1/p-1 Copied

Std. InChIKey:

HLXMSGPBTOZQDY-UHFFFAOYSA-M Copied
Cite this record
CSID:44079, http://www.chemspider.com/Chemical-Structure.44079.html (accessed 20:27, Jun 19, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

5-(1,3-Dimethylpentyl)-5-ethylbarbituric acid sodium salt

66941-14-8 [RN]

Barbituric acid, 5-(1,3-dimethylpentyl)-5-ethyl-, sodium salt

Sodium 5-(1,3-dimethylpentyl)-5-ethylbarbiturate

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Click to predict properties on the Chemicalize site

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