Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-

Base Information

Chemical Name:Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-
CAS No.:1079-01-2
Molecular Formula:C₁₂H₁₈O₂
Molecular Weight:194.274
Hs Code.:
European Community (EC) Number:214-088-5
UNII:TI50YAB469
DSSTox Substance ID:DTXSID70889329
Nikkaji Number:J217.202J
Wikidata:Q27289978
Mol file:1079-01-2.mol

Synonyms:1079-01-2;(+)-Myrtenyl acetate;2-Pinen-10-ol, acetate;Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-;FEMA No. 3765;TI50YAB469;[(1S,5R)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl acetate;Bicyclo(3.1.1)hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-;Bicyclo(3.1.1)hept-2-ene-2-methanol, 6,6-dimethyl-, acetate, (1S,5R)-;BICYCLO(3.1.1)HEPT-2-ENE-2-METHANOL, 6,6-DIMETHYL-, ACETATE, (1S)-;Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, acetate, (1S,5R)-;2-Pinen-10-yl acetate;UNII-TI50YAB469;SCHEMBL112576;(1S)-6,6-Dimethylbicyclo(3.1.1)hept-2-ene-2-methanol acetate;MYRTENYL ACETATE [FHFI];DTXSID70889329;EINECS 214-088-5;Q27289978;(1S)-(6,6-Dimethylbicyclo(3.1.1)hept-2-en-2-yl)methyl acetate

Suppliers and Price of Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-

Supply Marketing:

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
MYRTENYL ACETATE 95.00%
1KG
$ 7255.89

American Custom Chemicals Corporation
MYRTENYL ACETATE 95.00%
100G
$ 2493.41

Total 14 raw suppliers

Chemical Property of Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-

Chemical Property:

Vapor Pressure:0.032mmHg at 25°C
Refractive Index:n20/D 1.472(lit.)
Boiling Point:243.244°C at 760 mmHg
Flash Point:97.778°C
PSA：26.30000
Density:1.009g/cm³
LogP:2.54190
XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:194.130679813
Heavy Atom Count:14
Complexity:289

Purity/Quality:

98%,99%, ^*data from raw suppliers

MYRTENYL ACETATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)OCC1=CCC2CC1C2(C)C
Isomeric SMILES:CC(=O)OCC1=CC[C@@H]2C[C@H]1C2(C)C

Technology Process of Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-

There total 9 articles about Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)- 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: 100.0%

: 6712-78-3
myrtenol

: 108-24-7
acetic anhydride

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

Guidance literature:: In neat (no solvent); Molecular sieve; Microwave irradiation; Green chemistry;
DOI:10.3762/bjoc.12.214

Reference yield: 91.0%

: 6712-78-3
myrtenol

: 75-36-5
acetyl chloride

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

Guidance literature:: With triethylamine;
DOI:10.1016/S0040-4039(02)00337-4

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