CAS 24545-81-1|Bicyclo[3.1.0]hex-3-en-2-one,4-methyl-1-(1-methylethyl)-

Introduction：Basic information about CAS 24545-81-1|Bicyclo[3.1.0]hex-3-en-2-one,4-methyl-1-(1-methylethyl)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Synonyms

Common Name	Bicyclo[3.1.0]hex-3-en-2-one,4-methyl-1-(1-methylethyl)-
CAS Number	24545-81-1	Molecular Weight	150.21800
Density	1.057g/cm3	Boiling Point	214.1ºC at 760mmHg
Molecular Formula	C₁₀H₁₄O	Melting Point	/
MSDS	/	Flash Point	/

Names

Name	4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-3-en-2-one
Synonym	More Synonyms

Chemical & Physical Properties

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
InChIKey	LTTVJAQLCIHAFV-UHFFFAOYSA-N
SMILES	CC1=CC(=O)C2(C(C)C)CC12

Toxicological Information

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

Safety Information

HS Code	2914299000

Customs

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%

Synonyms

Thuj-3-en-2-on

thuj-3-en-2-one

3-Thujen-2-one

THUJEN-2-ONE

Umbellulon

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