347736
4-tert-Butylcyclohexyl acetate, mixture of cis and trans
99%
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About This Item
Linear Formula:
CH3CO2C6H10C(CH3)3
CAS Number:
Molecular Weight:
198.30
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Quality Level
Assay
99%
form
liquid
refractive index
n20/D 1.452 (lit.)
bp
228-230 °C/25 mmHg (lit.)
density
0.934 g/mL at 25 °C (lit.)
SMILES string
CC(=O)OC1CCC(CC1)C(C)(C)C
InChI
1S/C12H22O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h10-11H,5-8H2,1-4H3
InChI key
MBZRJSQZCBXRGK-UHFFFAOYSA-N
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General description
4-tert-Butylcyclohexyl acetate has been evaluated as a fragrance ingredient and its toxicologic and dermatological analysis has been reported. Cis and trans forms of 4-tert-butylcyclohexyl acetate are widely used as a perfume for cosmetics including soaps.
Application
4-tert-Butylcyclohexyl acetate may be used in the preparation of high loading fragrance encapsulation based on polymer-blend of ethylcellulose, hydroxypropyl methylcellulose and poly(vinyl alcohol).
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Aquatic Chronic 2 - Skin Sens. 1
WGK
WGK 2
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Aurapan Sansukcharearnpon et al.
International journal of pharmaceutics, 391(1-2), 267-273 (2010-02-23)
The six fragrances, camphor, citronellal, eucalyptol, limonene, menthol and 4-tert-butylcyclohexyl acetate, which represent different chemical functionalities, were encapsulated with a polymer-blend of ethylcellulose (EC), hydroxypropyl methylcellulose (HPMC) and poly(vinyl alcohol) (PV(OH)) using solvent displacement (ethanol displaced by water). The process
A Facile Stereoselective Biocatalytic Route to the Precursor of Woody Acetate.
Brown G, et al.
Organic Process Research & Development, 15(5), 1036-1039 (2011)
S P Bhatia et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 46 Suppl 12, S36-S41 (2008-10-10)
A toxicologic and dermatologic review of 4-tert-butylcyclohexyl acetate when used as a fragrance ingredient is presented.
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