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24545-81-1

24545-81-1 structure
24545-81-1 structure

Name 4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-3-en-2-one
Synonyms Thuj-3-en-2-on
thuj-3-en-2-one
3-Thujen-2-one
THUJEN-2-ONE
Umbellulon
Density 1.057g/cm3
Boiling Point 214.1ºC at 760mmHg
Molecular Formula C10H14O
Molecular Weight 150.21800
Exact Mass 150.10400
PSA 17.07000
LogP 2.17770
Vapour Pressure 0.159mmHg at 25°C
Index of Refraction 1.53

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XP0200000
CHEMICAL NAME :
3-Thujen-2-one
CAS REGISTRY NUMBER :
24545-81-1
BEILSTEIN REFERENCE NO. :
2042730
LAST UPDATED :
199707
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H14-O
MOLECULAR WEIGHT :
150.24
WISWESSER LINE NOTATION :
L35 DV EUTJ CY1&1 F1

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 :
1450 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: 22,777,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
965 mg/kg
TOXIC EFFECTS :
Behavioral - anticonvulsant Behavioral - sleep
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: 46,77,1957
HS Code 2914299000
HS Code 2914299000
Summary 2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%