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14357-94-9
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Basic Information
CAS No.: 14357-94-9
Name: 3-Allyl-5-(1-cyclohexen-1-yl)-1,5-dimethylbarbituric acid
Molecular Structure:
Molecular Structure of 14357-94-9 (3-Allyl-5-(1-cyclohexen-1-yl)-1,5-dimethylbarbituric acid)
Formula: C15H20 N2 O3
Molecular Weight: 276.335
Synonyms: 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-cyclohexen-1-yl)-3,5-dimethyl-5-(2-propenyl)- (9CI); Barbituric acid,1-allyl-5-(1-cyclohexen-1-yl)-3,5-dimethyl- (8CI); N-Allylhexobarbital
Density: 1.165g/cm3
Boiling Point: 371.2°C at 760 mmHg
Flash Point: 148.7°C
Safety: Moderately toxic by intraperitoneal and subcutaneous routes. When heated to decomposition it emits toxic vapors of NOx.
PSA: 57.69000
LogP: 1.97550
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  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-cyclohexen-1-yl)-1,5-dimethyl-3-(2-propen-1-yl)-

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    14357-94-9

    2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-cyclohexen-1-yl)-1,5-dimethyl-3-(2-propen-1-yl)-

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Chemistry

Empirical Formula: C15H20N2O3
Molecular Weight: 276.3309 g/mol
Index of Refraction: 1.539
Density: 1.165 g/cm3
Flash Point: 148.7 °C
Enthalpy of Vaporization: 61.82 kJ/mol
Boiling Point: 371.2 °C at 760 mmHg
Vapour Pressure: 1.05E-05 mmHg at 25 °C
Structure of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-3,5-dimethyl-1-(2-propenyl)- (CAS NO.14357-94-9):
                   
IUPAC Name of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-3,5-dimethyl-1-(2-propenyl)- (CAS NO.14357-94-9): 5-cyclohexen-1-yl-1,5-dimethyl-3-prop-2-enyl-1,3-diazinane-2,4,6-trione

Toxicity Data With Reference

1.    

ipr-mus LD50:>640 mg/kg

     RCOCB8    Research Communications in Chemical Pathology and Pharmacology. 54 (1986),191.
2.    

scu-mus LD50:770 mg/kg

     YKKZAJ    Yakugaku Zasshi. Journal of Pharmacy. 74 (1954),122.

Safety Profile

Moderately toxic by intraperitoneal and subcutaneous routes. When heated to decomposition 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-3,5-dimethyl-1-(2-propenyl)- (CAS NO.14357-94-9) emits toxic vapors of NOx.

Specification

 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-3,5-dimethyl-1-(2-propenyl)- ,its cas register number is 14357-94-9. It also can be called Barbituric acid, 3-allyl-5-(1-cyclohexen-1-yl)-1,5-dimethyl- ;and 3-Allyl-5-(1-cyclohexen-1-yl)-1,5-dimethylbarbituric acid .