Molecular structure of 5-(1-Methyl-1-butenyl)-5-propylbarbituric acid (CAS NO.6966-40-1) is:
Product Name: 5-(1-Methyl-1-butenyl)-5-propylbarbituric acid
CAS Registry Number: 6966-40-1
IUPAC Name: 5-[(Z)-pent-2-en-2-yl]-5-propyl-1,3-diazinane-2,4,6-trione
Molecular Weight: 238.28292 [g/mol]
Molecular Formula: C12H18N2O3
XLogP3-AA 2.2
H-Bond Donor: 2
H-Bond Acceptor: 3
Molar Volume: 217.5 cm3
Surface Tension: 36 dyne/cm
Density: 1.095 g/cm3
Classification Code: Drug / Therapeutic Agent
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 270mg/kg (270mg/kg) | Journal of the American Chemical Society. Vol. 61, Pg. 776, 1939. | |
mouse | LD50 | oral | 320mg/kg (320mg/kg) | Journal of the |
Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx. See also BARBITURATES.
5-(1-Methyl-1-butenyl)-5-propylbarbituric acid , its cas register number is 6966-40-1. It also can be called 4-24-00-02017 (Beilstein Handbook Reference) ; BRN 0225716 ; NSC 18781 ; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methyl-1-butenyl)-5-propyl- (9CI) ; Barbituric acid, 5-(1-methyl-1-butenyl)-5-propyl- .
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