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125-44-0

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Basic Information
CAS No.: 125-44-0
Name: 5-Ethyl-5-(1-methyl-1-butenyl)-2-sodiooxy-4,6(1H,5H)-pyrimidinedione
Molecular Structure:
Molecular Structure of 125-44-0 (5-Ethyl-5-(1-methyl-1-butenyl)-2-sodiooxy-4,6(1H,5H)-pyrimidinedione)
Formula: C11H16 N2 O3 . Na
Molecular Weight: 246.27
Synonyms: 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-ethyl-5-(1-methyl-1-butenyl)-, monosodium salt (9CI); Barbituric acid,5-ethyl-5-(1-methyl-1-butenyl)-, sodium salt (8CI);5-Ethyl-5-(1-methyl-1-butenyl)barbituric acid sodium salt; Delvinal sodium;Sodium 5-ethyl-5-(1-methyl-1-butenyl)barbiturate; Sodium Vinbarbital; Sodiumdelvinal; Vinbarbital sodium
Density: g/cm3
Boiling Point: °Cat760mmHg
Flash Point: °C
Safety: Poison by ingestion and intraperitoneal routes. Used as a sedative. When heated to decomposition it emits toxic fumes of Na2O and NOx. See also BARBITURATES.
PSA: 75.27000
LogP: 1.76270
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    2,4,6(1H,3H,5H)-Pyrimidinetrione,5-ethyl-5-(1-methyl-1-buten-1-yl)-, sodium salt (1:1)

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  • 5-Ethyl-5-(1-methyl-1-butenyl)-2-sodiooxy-4,6(1H,5H)-pyrimidinedione

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    5-Ethyl-5-(1-methyl-1-butenyl)-2-sodiooxy-4,6(1H,5H)-pyrimidinedione

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Chemistry

IUPAC Name: Sodium 5-ethyl-5-[(E)-1-methylbut-1-enyl]-4,6-dioxo-1H-pyrimidin-2-olate
Synonyms of Vinbarbital sodium (CAS NO.125-44-0) : 4,6(1H,5H)-pyrimidinedione, 5-ethyl-2-hydroxy-5-[(1E)-1-methyl-1-buten-1-yl]-, sodium salt (1:1) ; Sodium 5-ethyl-4,6-dioxo-5-[(2E)-pent-2-en-2-yl]-1,4,5,6-tetrahydropyrimidin-2-olate ; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(1-methyl-1-butenyl)-, monosodium salt ; Delvinal sodium ; Sodium 5-ethyl-5-(1-methyl-1-butenyl) barbiturate
InChI: InChI=1/C11H16N2O3.Na/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15;/h6H,4-5H2,1-3H3,(H2,12,13,14,15,16);/q;+1/p-1/b7-6+;
CAS NO:125-44-0
Molecular Formula:C11H15N2NaO3
Molecular Weight :246.2382
Molecular Structure :

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral 66mg/kg (66mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 68, Pg. 22, 1940.
rat LD50 intraperitoneal 80mg/kg (80mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 32, Pg. 180, 1943.
rat LD50 oral 143mg/kg (143mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 68, Pg. 22, 1940.

Safety Profile

Poison by ingestion and intraperitoneal routes.When Vinbarbital sodium (CAS NO.125-44-0) is heated to decomposition, it emits toxic fumes of Na2O and NOx. See also BARBITURATES.