2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-(3,3-dimethyl-1-butynyl)phenyl)-4-propyl-

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Names

[ CAS No. ]:
108613-94-1

[ Name ]:
2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-(3,3-dimethyl-1-butynyl)phenyl)-4-propyl-

Chemical & Physical Properties

[ Density]:
1.1g/cm3

[ Boiling Point ]:
398.2ºC at 760 mmHg

[ Molecular Formula ]:
C20H26O3

[ Molecular Weight ]:
314.41900

[ Flash Point ]:
135.2ºC

[ Exact Mass ]:
314.18800

[ PSA ]:
27.69000

[ LogP ]:
4.05800

[ Vapour Pressure ]:
3.44E-06mmHg at 25°C

[ Index of Refraction ]:
1.551

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YJ9270300
CHEMICAL NAME :
2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-(3,3-dimethyl-1-butynyl)phenyl)-4-propyl-
CAS REGISTRY NUMBER :
108613-94-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H26-O3
MOLECULAR WEIGHT :
314.46

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JAFCAU Journal of Agricultural and Food Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1953- Volume(issue)/page/year: 39,1335,1991

Related Compounds

  • (S)-tert-butyl 3-(pyrazin-2-ylamino)piperidine-1-carboxylate
  • 1-Benzhydryl-3-(2-cyclopropyl-2-hydroxy-2-phenylethyl)urea
  • (S)-tert-butyl 3-((6-chloropyrimidin-4-yl)amino)piperidine-1-carboxylate
  • 2,5-dichloro-N-((4-hydroxychroman-4-yl)methyl)benzamide
  • (S)-tert-butyl 3-((5-nitro-1H-benzo[d]imidazol-2-yl)amino)piperidine-1-carboxylate
  • (S)-tert-butyl 3-((5-nitrobenzo[d]oxazol-2-yl)amino)piperidine-1-carboxylate
  • (S)-tert-butyl 3-((5-nitrobenzo[d]thiazol-2-yl)amino)piperidine-1-carboxylate
  • (S)-tert-butyl 3-((6-nitroquinoxalin-2-yl)amino)piperidine-1-carboxylate
  • (S)-tert-butyl 3-(quinoxalin-2-ylamino)piperidine-1-carboxylate
  • (S)-tert-butyl 3-((3-chloroquinoxalin-2-yl)amino)piperidine-1-carboxylate
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