2,4,6 (1H,3H, 5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-(1-methylethenyl)-

Modify Date: 2024-09-17 08:32:07

2,4,6 (1H,3H, 5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-(1-methylethenyl)- Structure
2,4,6 (1H,3H, 5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-(1-methylethenyl)- structure
Common Name 2,4,6 (1H,3H, 5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-(1-methylethenyl)-
CAS Number 67051-29-0 Molecular Weight 238.28300
Density 1.085g/cm3 Boiling Point N/A
Molecular Formula C12H18N2O3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 5-(3-methylbutyl)-5-prop-1-en-2-yl-1,3-diazinane-2,4,6-trione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.085g/cm3
Molecular Formula C12H18N2O3
Molecular Weight 238.28300
Exact Mass 238.13200
PSA 75.27000
LogP 2.00870
Index of Refraction 1.476

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CQ7074900
CHEMICAL NAME :
Barbituric acid, 5-isopentyl-5-isopropenyl-
CAS REGISTRY NUMBER :
67051-29-0
BEILSTEIN REFERENCE NO. :
0225316
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C12-H18-N2-O3
MOLECULAR WEIGHT :
238.32
WISWESSER LINE NOTATION :
T6VMVMV FHJ FY1&U1 F2Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
450 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 61,96,1939
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
320 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 61,96,1939

 Synthetic Route

~%

2,4,6 (1H,3H, 5H)-Pyrimidinetrione, 5-(3-methylbutyl)-5-(1-methylethenyl)- Structure

2,4,6 (1H,3H, 5...

CAS#:67051-29-0

Literature: Cope; Hancock Journal of the American Chemical Society, 1939 , vol. 61, p. 96

 Synonyms

BARBITURIC ACID,5-ISOPENTYL-5-ISOPROPENYL
5-Isopentyl-5-isopropenylbarbituric acid
5-Isopentyl-5-isopropenyl-barbitursaeure