- A sustainable route from the renewable myrcene to methyl ethers via direct hydroalkoxylationBy Behr, Arno et al, Catalysis Science & Technology, 2012, 2(1), 88-92
Cas no 2565-82-4 (2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)-)
2565-82-4 structure
Product Name:2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)-
CAS No:2565-82-4
MF:C11O
MW:148.117102622986
CID:257431
Update Time:2025-04-19
2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)-
- (2E)-1-Methoxy-3,7-dimethyl-2,6-octadiene
- GERANYL METHYL ETHER
- (E)-1-Methoxy-3,7-dimethyl-2,6-octadiene
- (E)-1-methoxy-3,7-dimethylocta-2,6-diene
-
- Inchi： 1S/C11O/c1-10(2)6-5-7-11(3)8-9-12-4
- InChI Key： PUGTUYMATKMOIM-UHFFFAOYSA-N
- SMILES： [C]O[C]/[C]=C(\[C][C]/[C]=C(\[C])/[C])/[C] |^1:0,3,7,9,10,11,^4:2,5,6|
Computed Properties
- Exact Mass: 168.1515
- Monoisotopic Mass: 168.151
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 162
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 9.2A^2
Experimental Properties
- Density: 0.827
- Boiling Point: 220.3°Cat760mmHg
- Flash Point: 73.5°C
- Refractive Index: 1.449
- PSA: 9.23
- LogP: 3.32550
2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)- Production Method
Production Method 1
Reaction Conditions
1.1R:KH, S:THF, 15 min, cooled; rt; 2 h, rt
1.2S:THF, 10 min, rt; 3 h, rt
2.1C:AlCl3, S:Me2CO, 4 h, 80°C, 0.5 MPa
1.2S:THF, 10 min, rt; 3 h, rt
2.1C:AlCl3, S:Me2CO, 4 h, 80°C, 0.5 MPa
Reference
2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)- Raw materials
2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)- Preparation Products
2,6-Octadiene,1-methoxy-3,7-dimethyl-, (2E)- Related Literature
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1. Organometallic derivatives of natural products: dicobalt hexacarbonyl complexes of geranyl-alkynesAngela Moore,Johannes Ostermann,Yannick Ortin,Michael J. McGlinchey New J. Chem. 2016 40 7881
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Arno Behr,Leif Johnen,Peter Neubert Catal. Sci. Technol. 2012 2 88
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Fabien Gelat,Claire Lacomme,Olivier Berger,Laurent Gavara,J.-L. Montchamp Org. Biomol. Chem. 2015 13 825
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Navnidhi Chhikara,Ragni Kour,Sundeep Jaglan,Pawan Gupta,Yogesh Gat,Anil Panghal Food Funct. 2018 9 1978
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K. Dunne,F. J. McQuillin J. Chem. Soc. C 1970 2196
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