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| CAS No.: | 56-29-1 |
|---|---|
| Name: | HEXOBARBITAL |
| Article Data: | 9 |
| Molecular Structure: | |
|
|
|
| Formula: | C12H16 N2 O3 |
| Molecular Weight: | 236.271 |
| Synonyms: | Barbituricacid, 5-(1-cyclohexen-1-yl)-1,5-dimethyl- (8CI); (RS)-Hexobarbital; (?à)-5-(1-Cyclohexen-1-yl)-1,5-dimethylbarbituricacid; (?à)-Hexobarbital; (?à)-Hexobarbitone;1,5-Dimethyl-5-(1-cyclohexenyl)barbituric acid;5-(1-Cyclohexen-1-yl)-1,5-dimethylbarbituric acid;5-(1-Cyclohexenyl-1)-1-methyl-5-methylbarbituric acid; Barbidorm; Citodon; Citopan;Cyclonal; Cyclopan; Dorico; Enhexymal; Evipal; Evipan; Hexanastab Oral; Hexenal(barbiturate); Hexobarbital; Hexobarbitone; Methexenyl; Methylhexabarbital;Methylhexabital; N-Methyl-5-cyclohexenyl-5-methylbarbituric acid; NSC 71929;Narcosan; Noctivane; Sombucaps; Sombulex; Somnalert |
| EINECS: | 200-264-9 |
| Density: | 1.225 g/cm3 |
| Melting Point: | 145-147° |
| Boiling Point: | 368.8 °C at 760 mmHg |
| Flash Point: | 176.8 °C |
| Solubility: | 434.7mg/L(25 oC) |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 22 |
| Safety: | Poison by subcutaneous, intraperitoneal, intravenous, intrapleural, and rectal routes. Moderately toxic by ingestion. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also BARBITURATES. |
| PSA: | 66.48000 |
| LogP: | 1.46800 |
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Chemistry
IUPAC Name: 5-Cyclohexen-1-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione
CAS: 56-29-1
Formula: C12H16N2O3
Molecular Weight: 236.27
The Molecular Structure of 5-Cyclohexen-1-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione (CAS NO.56-29-1):
Density: 1.225 g/cm3
Flash Point: 176.8 °C
Boiling Point: 368.8 °C at 760 mmHg
Index of Refraction: 1.538
Molar Refractivity: 60.38 cm3
Molar Volume: 192.8 cm3
Polarizability: 23.93×10-24cm3
Surface Tension: 45.8 dyne/cm
Enthalpy of Vaporization: 71.22 kJ/mol
Vapour Pressure: 6.12E-07 mmHg at 25°C
Water Solubility: 573.4 (mg/L) at 25°C
Toxicity Data With Reference
| 1. | cyt-hmn:leu 1500 mg/L | TGANAK Tsitologiya i Genetika. 18 (1)(1984),13. | ||
| 2. | ipr-rat LD50:330 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 184 (1970),5. | ||
| 3. | scu-rat LDLo:400 mg/kg | AEPPAE Naunyn-Schmiedeberg’s Archiv fuer Experimentelle Pathologie und Pharmakologie. 182 (1936),348. | ||
| 4. | orl-mus LD50:468 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 106 (1952),444. | ||
| 5. | ipr-mus LD50:270 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 5 (1963),790. | ||
| 6. | scu-mus LD50:250 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 15 (1965),688. | ||
| 7. | ivn-mus LD50:133 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 163 (1966),11. | ||
| 8. | ipl-mus LDLo:340 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 134 (1961),95. | ||
| 9. | orl-rbt LDLo:1200 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 60 (1937),189. | ||
| 10. | ivn-rbt LDLo:80 mg/kg | JPETAB Journal of Phar |
Safety Profile
Poison by subcutaneous, intraperitoneal, intravenous, intrapleural, and rectal routes. Moderately toxic by ingestion. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also BARBITURATES.
Safety Information about 5-Cyclohexen-1-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione (CAS NO.56-29-1):
Hazard Codes:
Xn:
T:
F: 
Risk Statements about 5-Cyclohexen-1-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione (CAS NO.56-29-1):
R22: Harmful if swallowed.
R39/23/24/25: 39/23/24/25: Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed.
R23/24/25: Toxic by inhalation, in contact with skin and if swallowed.
R11: Highly Flammable.
Safety Statements about 5-Cyclohexen-1-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione (CAS NO.56-29-1):
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
S45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).
S36/37: Wear suitable protective clothing and gloves.
S16: Keep away from sources of ignition - No smoking.
RIDADR: 3249
WGK Germany: 3
RTECS: CQ2625000
HazardClass: 6.1(b)
PackingGroup: III
Specification
5-Cyclohexen-1-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione with CAS number of 56-29-1 is also known as 5-[1-Cyclohexenyl]-1,5-dimethylbarbituric acid ; Labotest-bb lt00244803 ; Evipal ; Hexobarbital ; 1,5-Dimethyl-5-(1-cyclohexenyl)barbituric acid ; 1,5-Dimethyl-5-(1-cyclohexenyl)barbituricacid ; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-1,5-dimethyl- ; 5-(1-Cyclohexen-1-yl)-1,5-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione . This product shoud be storaged at 2-8°C. It can be used as a drunken drug.