-
Name
5,5-dibutylbarbituric acid
- EINECS
- CAS No. 17013-41-1
- Article Data6
- CAS DataBase
- Density 1.055g/cm3
- Solubility
- Melting Point
- Formula C12H20 N2 O3
- Boiling Point °Cat760mmHg
- Molecular Weight 240.302
- Flash Point °C
- Transport Information
- Appearance
- Safety Poison by ingestion and intraperitoneal routes. Moderately toxic by subcutaneous route. An hypnotic agent. When heated to decomposition it emits toxic fumes of NOx. See also BARBITURATES.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Barbituricacid, 5,5-dibutyl- (8CI); 5,5-Dibutylbarbituric acid
- PSA 82.25000
- LogP 2.27100
5,5-Dibutylbarbituric acid Chemical Properties
Molecular structure of 5,5-Dibutylbarbituric acid (CAS NO.17013-41-1) is:
Product Name: 5,5-Dibutylbarbituric acid
CAS Registry Number: 17013-41-1
IUPAC Name: 5,5-dibutyl-1,3-diazinane-2,4,6-trione
Molecular Weight: 240.2988 [g/mol]
Molecular Formula: C12H20N2O3
XLogP3: 2.7
H-Bond Donor: 2
H-Bond Acceptor: 3
EINECS: 241-088-2
Molar Volume: 227.6 cm3
Surface Tension: 33.9 dyne/cm
Density: 1.055 g/cm3
Classification Code: Drug / Therapeutic Agent
5,5-Dibutylbarbituric acid Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| cat | LDLo | oral | 350mg/kg (350mg/kg) | BEHAVIORAL: SLEEP GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS GASTROINTESTINAL: NAUSEA OR VOMITING | Journal of Pharmacology and Experimental Therapeutics. Vol. 26, Pg. 371, 1926. |
| mouse | LD50 | intraperitoneal | 232mg/kg (232mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 89, Pg. 356, 1947. | |
| rabbit | LDLo | subcutaneous | 500mg/kg (500mg/kg) | Journal of the American Chemical Society. Vol. 45, Pg. 243, 1923. |
5,5-Dibutylbarbituric acid Safety Profile
Poison by ingestion and intraperitoneal routes. Moderately toxic by subcutaneous route. An hypnotic agent. When heated to decomposition it emits toxic fumes of NOx. See also BARBITURATES.
5,5-Dibutylbarbituric acid Specification
5,5-Dibutylbarbituric acid , its cas register number is 17013-41-1. It also can be called 5,5-Dibutyl-2,4,6(1H,3H,5H)-pyrimidinetrione ; 5-24-09-00180 (Beilstein Handbook Reference) ; BRN 0228080 ; Dibutylbarbituric acid ; EINECS 241-088-2 ; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-dibutyl- (9CI) ; 5,5-Dibutylbarbituric acid ; Barbituric acid, 5,5-dibutyl- .
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