4-Thiomorpholinamine,N-[[2-(5-nitro-2-furanyl)-4-thiazolyl]methylene]-, 1,1-dioxide
Names
[ CAS No. ]:
31898-49-4
[ Name ]:
4-Thiomorpholinamine,N-[[2-(5-nitro-2-furanyl)-4-thiazolyl]methylene]-, 1,1-dioxide
[Synonym ]:
Acetonitrile,[(1,1-dioxido-1,2-benzisothiazol-3-yl)thio]
2-((1,1-Dioxidobenzo[d]isothiazol-3-yl)thio)acetonitrile
Chemical & Physical Properties
[ Density]:
1.72g/cm3
[ Boiling Point ]:
681.8ºC at 760 mmHg
[ Molecular Formula ]:
C12H12N4O5S2
[ Molecular Weight ]:
356.37700
[ Flash Point ]:
366.2ºC
[ Exact Mass ]:
356.02500
[ PSA ]:
158.21000
[ LogP ]:
2.91750
[ Index of Refraction ]:
1.755
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XM0230000
- CHEMICAL NAME :
- 4-Thiomorpholinamine, N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-, 1,1-dioxide
- CAS REGISTRY NUMBER :
- 31898-49-4
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C12-H12-N4-O5-S2
- MOLECULAR WEIGHT :
- 356.40
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >1600 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 20,946,1977
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >800 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 20,946,1977