ChemicalBook--->CAS DataBase List--->35044-59-8

35044-59-8

35044-59-8 Structure

35044-59-8 Structure
IdentificationBack Directory
[Name]

ethyl 2,6,6-trimethylcyclohexa-1,3-ene-1-carboxylate
[CAS]

35044-59-8
[Synonyms]

Ethyl-2,6,6-trimethylcyclohexa-1,3-en-1-carboxylat
2,2,6-Trimethyl-2,3-dihydrobenzoic acid ethyl ester
ethyl 2,6,6-triMethylcyclohexa-1,3-dienecarboxylate
ethyl 2,6,6-trimethylcyclohexa-1,3-ene-1-carboxylate
Ethyl2,6,6-trimethyl-1,3-cyclohexadiene-1-carboxylate
2,6,6-Trimethyl-1,3-cyclohexadiene-1-carboxylic acid ethyl ester
1,3-Cyclohexadiene-1-carboxylic acid, 2,6,6-trimethyl-, ethyl ester
[EINECS(EC#)]

252-335-9
[Molecular Formula]

C12H18O2
[MOL File]

35044-59-8.mol
[Molecular Weight]

194.27
Chemical PropertiesBack Directory
[Boiling point ]

93-95 °C(Press: 11 Torr)
[density ]

0.963±0.06 g/cm3(Predicted)
[vapor pressure ]

25.86Pa at 25℃
[Odor]

at 10.00 % in dipropylene glycol. fresh natural herbal damascon rose apple woody
[Odor Type]

floral
[Water Solubility ]

78.5mg/L at 20℃
[LogP]

3.9 at 35℃
[EPA Substance Registry System]

1,3-Cyclohexadiene-1-carboxylic acid, 2,6,6-trimethyl-, ethyl ester (35044-59-8)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H317-H412
[Precautionary statements ]

P273-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Hazard InformationBack Directory
[Chemical Properties]

The commercial quality also contains the α- and γ-isomers, ethyl 2,6,6-trimethyl- 2,4-cyclohexadiene-1-carboxylate and ethyl 6,6-dimethyl-2- methylene-3-cyclohexene-1-carboxylate. Ethyl 2,6,6-Trimethyl-1,3-cyclohexadiene-1-carboxylate is a colorless to slightly yellow liquid with a natural rose odor with aspects of apple cider and woody cedar. It is recommended for use in floral and fruity fragrances for shampoos, toiletries, and detergents.
The preparation of the material starts from mesityl oxide and ethyl acetoacetate, which are cyclized under acidic conditions.The resulting ethyl 4-oxo-2,6,6- trimethyl-2-cyclohexenecarboxylate is subsequently reduced and dehydrated.
[Flammability and Explosibility]

Nonflammable
[Trade name]

Ethyl Safranate (Givaudan)
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