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

Modify Date: 2024-01-26 11:23:43

2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-(3,3-dimethyl-1-butynyl)phenyl)-4-propyl- Structure
2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-(3,3-dimethyl-1-butynyl)phenyl)-4-propyl- structure
Common Name 2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-(3,3-dimethyl-1-butynyl)phenyl)-4-propyl-
CAS Number 108613-94-1 Molecular Weight 314.41900
Density 1.1g/cm3 Boiling Point 398.2ºC at 760 mmHg
Molecular Formula C20H26O3 Melting Point N/A
MSDS N/A Flash Point 135.2ºC

 Names

Name 4-[4-(3,3-dimethylbut-1-ynyl)phenyl]-1-propyl-3,5,8-trioxabicyclo[2.2.2]octane

 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
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