Product Name

  • Name

    TALBUTAL CIII (250 MG)

  • EINECS
  • CAS No. 115-44-6
  • Density 1.098g/cm3
  • Solubility 2.16g/L(temperature not stated)
  • Melting Point 108-110°
  • Formula C11H16 N2 O3
  • Boiling Point °Cat760mmHg
  • Molecular Weight 224.26
  • Flash Point °C
  • Transport Information
  • Appearance
  • Safety Poison by ingestion, intraperitoneal, and intravenous routes. Human psychotropic effects by ingestion. When heated to decomposition it emits toxic NOx. See also BARBITURATES and ALLYL COMPOUNDS. A sedative and hypnotic agent.
  • Risk Codes
  • Molecular Structure Molecular Structure of 115-44-6 (TALBUTAL CIII (250 MG))
  • Hazard Symbols
  • Synonyms 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-methylpropyl)-5-(2-propenyl)- (9CI); Barbituric acid, 5-allyl-5-sec-butyl-(6CI,7CI,8CI); 5-Allyl-5-(1-methylpropyl) barbituric acid;5-Allyl-5-sec-butylbarbituric acid; Lotusate; Profundol; Talbutal
  • PSA 75.27000
  • LogP 1.61860

Synthetic route

s-butyl bromide
78-76-2, 5787-31-5

s-butyl bromide

5-allyl-pyrimidine-2,4,6-trione
2565-43-7

5-allyl-pyrimidine-2,4,6-trione

talbutal
115-44-6

talbutal

Conditions
ConditionsYield
With sodium hydroxide
(+-)-allyl-sec-butyl-malonic acid diethyl ester

(+-)-allyl-sec-butyl-malonic acid diethyl ester

talbutal
115-44-6

talbutal

Conditions
ConditionsYield
With sodium ethanolate; urea
talbutal
115-44-6

talbutal

allyl-sec-butyl-malonic acid-monoureide

allyl-sec-butyl-malonic acid-monoureide

Conditions
ConditionsYield
With alkaline solution
talbutal
115-44-6

talbutal

Allyl-(1-methylpropyl)-acetamid
90949-61-4

Allyl-(1-methylpropyl)-acetamid

Conditions
ConditionsYield
With ammonia at 200℃;

5-ALLYL-5-sec-BUTYLBARBITURIC ACID Chemical Properties

Product Name: 5-Allyl-5-sec-butylbarbituric acid (CAS NO.115-44-6)


Molecular Formula: C11H16N2O3
Molecular Weight: 224.25634g/mol
Mol File: 115-44-6.mol
Einecs: 204-090-4
Density: 1.098g/cm3
Surface Tension: 34.9 dyne/cm
XLogP3: 1.4
H-Bond Donor: 2
H-Bond Acceptor: 3

5-ALLYL-5-sec-BUTYLBARBITURIC ACID Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 75mg/kg (75mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
duck LD50 oral 100mg/kg (100mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
mouse LDLo intravenous 143mg/kg (143mg/kg)   Compilation of LD50 Values of New Drugs.
pigeon LD50 oral 56mg/kg (56mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
rabbit LDLo intraperitoneal 55mg/kg (55mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 44, Pg. 325, 1932.
rabbit LDLo intravenous 50mg/kg (50mg/kg)   Journal of the American Chemical Society. Vol. 57, Pg. 1961, 1935.
rabbit LDLo oral 100mg/kg (100mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 44, Pg. 325, 1932.
rat LD50 oral 57500ug/kg (57.5mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
rat LDLo intraperitoneal 75mg/kg (75mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 44, Pg. 325, 1932.
rat LDLo intravenous 68mg/kg (68mg/kg)   Compilation of LD50 Values of New Drugs.

5-ALLYL-5-sec-BUTYLBARBITURIC ACID Safety Profile

Poison by ingestion, intraperitoneal, and intravenous routes. Human psychotropic effects by ingestion. When heated to decomposition it emits toxic NOx. See also BARBITURATES and ALLYL COMPOUNDS. A sedative and hypnotic agent.

5-ALLYL-5-sec-BUTYLBARBITURIC ACID Specification

 5-Allyl-5-sec-butylbarbituric acid ,its CAS NO. is 115-44-6,the synonyms is Taibutal CIII (250 MG) ; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylpropyl)-5-(2-propenyl)- ; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methypropyl)-5-(2-propenyl)- ; 5-(1-Methylpropyl)-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione ; 5-(1-methylpropyl)-5-(2-propenyl)-2,4-6(1h,3h,5h)-pyrimidinetrione ; 5-Allyl-5-(1-methylpropyl) barbituric acid ; 5-allyl-5-(1-methylpropyl)barbituricacid ; 5-Allyl-5-sec-butyl-2,4,6(1H,3H,5H)-pyrimidinetrione .

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