Perillyl acetate

Base Information Edit

Chemical Name:Perillyl acetate
CAS No.:15111-96-3
Molecular Formula:C12H18 O2
Molecular Weight:194.274
Hs Code.:2915390090
European Community (EC) Number:239-162-4
UNII:7P95D01XYJ
DSSTox Substance ID:DTXSID4051740
Nikkaji Number:J241.400G
Wikidata:Q81984803
Metabolomics Workbench ID:47700
Mol file:15111-96-3.mol

Synonyms:Perillyl acetate;Perilla acetate;15111-96-3;Dihydrocuminyl acetate;p-Mentha-1,8-dien-7-yl acetate;Menthadien-7-carbinyl acetate;p-Mentha-1,8-dien-7-ol, acetate;1-Cyclohexene-1-methanol, 4-(1-methylethenyl)-, acetate;FEMA No. 3561;1,8-P-Menthadien-7-yl acetate;(4-prop-1-en-2-ylcyclohexen-1-yl)methyl acetate;EINECS 239-162-4;DIHYDRO CUMINYL ACETATE;4-(1-Methylvinyl)cyclohex-1-ene-1-methyl acetate;4-Isopropenyl-1-cyclohexene carbinyl acetate;UNII-7P95D01XYJ;4-(1-Methylethenyl)-1-cyclohexene-1-methyl acetate;7P95D01XYJ;(4-Isopropenyl-1-cyclohexen-1-yl)methyl acetate;1-Cyclohexene-1-methanol, 4-(1-methylethenyl)-, 1-acetate;[4-(PROP-1-EN-2-YL)CYCLOHEX-1-EN-1-YL]METHYL ACETATE;Cyclohex-1-ene-1-methanol-4-(1-methylethenyl)-acetate;Perilla alcohol, acetate;SCHEMBL1302136;DTXSID4051740;FEMA 3561;AKOS006274505;4-i-propenylcyclohex-1-enylmethyl acetate;LS-179020;P-MENTHA-1,8-DIEN-7-YL ACETATE [FHFI];(+/-)-P-MENTHA-1,8-DIEN-7-YL ACETATE;(4-prop-1-en-2-yl-1-cyclohexenyl)methyl acetate;4-ISOPROPENYL-1-CYCLOHEXENE CARBINOL ACETATE;P-MENTHA-1,8-DIEN-7-YL ACETATE, (+/-)-;4-(1-METHYLVINYL)CYCLOHEX-1-ENE-1-METHYLACETATE;4 - (1 - methylvinyl)cyclohex - 1 - ene - 1 - methyl acetate

Suppliers and Price of Perillyl acetate

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
DIHYDRO CUMINYL ACETATE 95.00%
5MG
$ 495.98

Total 5 raw suppliers

Chemical Property of Perillyl acetate Edit

Chemical Property:

Vapor Pressure:0.0138mmHg at 25°C
Boiling Point:258.4°Cat760mmHg
Flash Point:98.9°C
PSA：26.30000
Density:0.967g/cm³
LogP:2.85210
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:194.130679813
Heavy Atom Count:14
Complexity:264

Purity/Quality:

99% ^*data from raw suppliers

DIHYDRO CUMINYL ACETATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=C)C1CCC(=CC1)COC(=O)C

Technology Process of Perillyl acetate

There total 17 articles about Perillyl acetate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

: 536-59-4,18457-55-1
(-)-perillyl alcohol

: 108-24-7
acetic anhydride

: 15111-96-3,56452-54-1,35907-08-5
(S)-(4-(prop-1-en-2-yl)cyclohex-1-en-1-yl)methyl acetate

Guidance literature:: With pyridine; In dichloromethane; at 0 - 20 ℃;
DOI:10.1016/j.tetlet.2014.01.039

Reference yield: 85.0%

: 581-55-5
benzylidene 1,1-diacetate

: 536-59-4,18457-55-1
(-)-perillyl alcohol

: 15111-96-3,56452-54-1,35907-08-5
(S)-(4-(prop-1-en-2-yl)cyclohex-1-en-1-yl)methyl acetate

Guidance literature:: With potassium carbonate; at 90 ℃; for 16h;
DOI:10.1016/j.tet.2018.09.014

Reference yield: 23.0%

: 108-24-7
acetic anhydride

: 23516-38-3
β-pinene trans-epoxide

: 15111-96-3
(4-isopropenyl-1-cyclohexen-1-yl)methyl acetate

: 35670-93-0,36203-31-3,1079-01-2
(1R)-(-)-myrtenyl acetate

: (2-endo-acetoxy-7,7-dimethylbicyclo[2.2.1]hept-1-yl)methyl acetate

: 4-(1-acetoxy-1-methylethyl)cyclohex-1-ethylmethyl acetate

Guidance literature:: Montmorillonite clay K₁₀; In dichloromethane; at 20 ℃; for 1.5h; Further byproducts given;
DOI:10.1023/B:RUJO.0000010173.38389.06