4-Morpholinamine,N-[[2-(5-nitro-2-thienyl)-4-thiazolyl]methylene]-

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Names

[ CAS No. ]:
31898-42-7

[ Name ]:
4-Morpholinamine,N-[[2-(5-nitro-2-thienyl)-4-thiazolyl]methylene]-

Chemical & Physical Properties

[ Density]:
1.61g/cm3

[ Boiling Point ]:
571.3ºC at 760mmHg

[ Molecular Formula ]:
C12H12N4O3S2

[ Molecular Weight ]:
324.37900

[ Flash Point ]:
299.3ºC

[ Exact Mass ]:
324.03500

[ PSA ]:
140.02000

[ LogP ]:
2.90700

[ Index of Refraction ]:
1.76

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QD5730000
CHEMICAL NAME :
4-Morpholinamine, N-((2-(5-nitro-2-thienyl)-4-thiazolyl)methylene)-
CAS REGISTRY NUMBER :
31898-42-7
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C12-H12-N4-O3-S2
MOLECULAR WEIGHT :
324.40

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: 18,794,1975
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: 18,794,1975

Synthetic Route

Precursor & DownStream

Precursor

  • 4-chloromethyl-2-(5-nitro-thiophen-2-yl)-thiazole
  • N,N-dimethyl-N'-[2-(5-nitro-thiophen-2-yl)-thiazol-4-ylmethylene]-benzene-1,4-diamine N'-oxide
  • 1-[2-(5-nitro-thiophen-2-yl)-thiazol-4-ylmethyl]-pyridinium, chloride
  • 1-[2-(5-nitro-thiophen-2-yl)-thiazol-4-ylmethyl]-1,3,5,7-tetraaza-adamantanium, chloride
  • 4-Morpholinamine
  • 2-(5-nitrothiophen-2-yl)-1,3-thiazole-4-carbaldehyde

DownStream