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64038-10-4

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Basic Information
CAS No.: 64038-10-4
Name: 5-Ethyl-5-hexyl-2-sodiothio-4,6(1H,5H)-pyrimidinedione
Molecular Structure:
Molecular Structure of 64038-10-4 (5-Ethyl-5-hexyl-2-sodiothio-4,6(1H,5H)-pyrimidinedione)
Formula: C12H20 N2 O2 S . Na
Molecular Weight: 278.38
Synonyms: 4,6(1H,5H)-Pyrimidinedione,5-ethyl-5-hexyldihydro-2-thioxo-, monosodium salt (9CI)
Safety: Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of SOx, NOx, and Na2O. See also BARBITURATES.
PSA: 100.10000
LogP: 2.30840
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Chemistry

IUPAC Name: Sodium 5-ethyl-5-hexyl-2-sulfanylidenepyrimidin-3-ide-4,6-dione
Synonyms of Sodium hexylethyl thiobarbiturate (CAS NO.64038-10-4): 5-Ethyl-5-hexyl-2-thiobarbituric acid sodium salt ; Barbituric acid,5-ethyl-5-hexyl-2-thio-,sodium salt
CAS NO: 64038-10-4
Molecular Formula: C12H19N2NaO2S
Molecular Weight : 278.3462
Molecular Structure:
H bond acceptors: 4
H bond donors: 2
Freely Rotating Bonds: 6
Polar Surface Area: 84.99 Å2

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LDLo intravenous 100mg/kg (100mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 60, Pg. 125, 1937.
mouse LDLo intravenous 220mg/kg (220mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 60, Pg. 125, 1937.
rabbit LDLo intravenous 70mg/kg (70mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 60, Pg. 125, 1937.
rat LDLo intraperitoneal 200mg/kg (200mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 60, Pg. 125, 1937.
rat LDLo oral 600mg/kg (600mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 60, Pg. 125, 1937.

Safety Profile

Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion. When Sodium hexylethyl thiobarbiturate (CAS NO.64038-10-4) is heated to decomposition ,it emits toxic fumes of SOx, NOx, and Na2O. See also BARBITURATES.