allyl cyclohexyl acetate

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Names

[ Name ]:
allyl cyclohexyl acetate

[Synonym ]:
cyclohexyl-acetic acid allyl ester
Cyclohexylessigsaeure-allylester
Allyl cyclohexaneacetate
Cyclohexaneacetic acid,2-propenyl ester
ALLYLCYCLOHEXYLACETATE

Chemical & Physical Properties

[ Density]:
0.948g/cm3

[ Boiling Point ]:
246.7ºC at 760mmHg

[ Molecular Formula ]:
C₁₁H₁₈O₂

[ Molecular Weight ]:
182.25900

[ Flash Point ]:
98.8ºC

[ Exact Mass ]:
182.13100

[ PSA ]:
26.30000

[ LogP ]:
2.68600

[ Index of Refraction ]:
1.458

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GU6495000

CHEMICAL NAME :: Cyclohexaneacetic acid, allyl ester

CAS REGISTRY NUMBER :: 4728-82-9

BEILSTEIN REFERENCE NO. :: 2575626

LAST UPDATED :: 199701

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C11-H18-O2

MOLECULAR WEIGHT :: 182.29

WISWESSER LINE NOTATION :: L6TJ A1VO2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Human

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 15,617,1977

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 15,617,1977 ** ACUTE TOXICITY DATA **

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 900 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 15,617,1977

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 1250 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 15,617,1977

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

2-diazonio-1-prop-2-enoxyethenolate
cyclohexane

DownStream

Related Compounds

allyl cyclohexyl valerate
Allyl acetate
(1-ALLYL-CYCLOHEXYL)-FURAN-2-YLMETHYL-AMINE
Methyl amino(cyclohexyl)acetate hydrochloride (1:1)
diethyl 2-((allyl(cyclohexyl)amino)methylene)malonate
1-(cyclohexylethynyl)cyclohexyl acetate
[(2-Bromo-4-methylphenyl)methyl](butan-2-yl)amine
N-(3-hydroxy-4,4-dimethylpentyl)cyclobutanecarboxamide
N-(4-Cyanooxan-4-yl)-3-(cyclopropylmethoxymethyl)-4-fluorobenzamide
N-(4-Cyanooxan-4-YL)-5-(4-ethylphenyl)furan-2-carboxamide
N-(4-Cyanooxan-4-YL)-3-(4-propoxyphenyl)propanamide
N-(1-Cyanocyclopropyl)-2-[2-(4-methyl-1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide
3-Bromo-N-(1-cyanocyclopropyl)-2-methylbenzamide
N-(1-Cyanocyclopropyl)-3-(5-cyclopropyl-1,2,4-oxadiazol-3-YL)benzamide
N-(1-Cyanocyclopropyl)-5-(2,2-dimethylpropanoylamino)-2-fluorobenzamide
N-(1-Cyanocyclopropyl)-3-methyloctanamide

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