5-[(E)-but-2-enyl]-5-(2-methylpropyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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Names
[ CAS No. ]:
67050-02-6
[ Name ]:
5-[(E)-but-2-enyl]-5-(2-methylpropyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
[Synonym ]:
5-(2-Butenyl)-5-isobutyl-2-sodiothio-4,6(1H,5H)-pyrimidinedione
Chemical & Physical Properties
[ Density]:
1.17g/cm3
[ Molecular Formula ]:
C12H18N2NaO2S+
[ Molecular Weight ]:
277.33800
[ Exact Mass ]:
277.09900
[ PSA ]:
90.29000
[ LogP ]:
2.17360
[ Index of Refraction ]:
1.558
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- CQ1433500
- CHEMICAL NAME :
- Barbituric acid, 5-(2-butenyl)-5-isobutyl-2-thio-, sodium salt
- CAS REGISTRY NUMBER :
- 67050-02-6
- LAST UPDATED :
- 199107
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C12-H18-N2-O2-S.Na
- MOLECULAR WEIGHT :
- 277.37
- WISWESSER LINE NOTATION :
- T6VMYNV FHJ CUS F2U2 F1Y1&1 &-NA- &31/6
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 252 mg/kg
- TOXIC EFFECTS :
- Behavioral - tremor Behavioral - convulsions or effect on seizure threshold
- REFERENCE :
- JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 34,183,1945
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 114 mg/kg
- TOXIC EFFECTS :
- Behavioral - tremor Behavioral - convulsions or effect on seizure threshold
- REFERENCE :
- JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 34,183,1945