Geranyl hexanoate

Base Information

Chemical Name:Geranyl hexanoate
CAS No.:68310-59-8
Molecular Formula:C16H28O2
Molecular Weight:252.397
Hs Code.:
European Community (EC) Number:233-102-0,269-718-1
UNII:7YL4OO10LS
DSSTox Substance ID:DTXSID20881398
Nikkaji Number:J149.332I
Wikidata:Q27269023
Metabolomics Workbench ID:4263
Mol file:68310-59-8.mol

Synonyms:Geranyl caproate;Geranyl hexanoate;10032-02-7;FEMA No. 2515;Hexanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-;Geranyl hexanoate (natural);[(2E)-3,7-dimethylocta-2,6-dienyl] hexanoate;Hexanoic acid, (2E)-3,7-dimethyl-2,6-octadienyl ester;EINECS 233-102-0;2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, HEXANOATE, (E)-;UNII-7YL4OO10LS;(E)-3,7-Dimethylocta-2,6-dien-1-yl n-hexanoate;7YL4OO10LS;Neryl caproate;AI3-36014;Hexanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester;Hexanoic acid, 3,7-dimethylocta-2,6-dien-1-yl ester, (E)-;3,7-Dimethyl-2,6-octadienyl hexanoate, (E)-;3,7-Dimethyl-2,6-octadien-1-yl hexanoate, trans-;EINECS 269-718-1;(E)-3,7-Dimethyl-2,6-octadienyl hexanoate;WE(8:2(2E,6E)(3Me,7Me)/6:0);Geranyl n-hexanoate;Hexanoic acid, (2Z)-3,7-dimethyl-2,6-octadienyl ester;68310-59-8;GERANYLCAPROATE;(2E)-3,7-Dimethyl-2,6-octadienyl hexanoate;GERANIOL CAPROATE;GERANIOL HEXANOATE;Geranyl caproate, AldrichCPR;SCHEMBL874133;SCHEMBL874134;GERANYL HEXANOATE [FHFI];DTXSID20881398;ARVSCQUZFFSNKF-NTCAYCPXSA-N;LMFA07010618;LS-2769;Q27269023

Suppliers and Price of Geranyl hexanoate

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

Total 5 raw suppliers

Chemical Property of Geranyl hexanoate

Chemical Property:

Boiling Point:333.3±21.0 °C(Predicted)
PSA：26.30000
Density:0.891±0.06 g/cm3(Predicted)
LogP:4.80260
XLogP3:5.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:10
Exact Mass:252.208930132
Heavy Atom Count:18
Complexity:284

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC(=O)OCC=C(C)CCC=C(C)C
Isomeric SMILES:CCCCCC(=O)OC/C=C(\C)/CCC=C(C)C

Technology Process of Geranyl hexanoate

There total 2 articles about Geranyl hexanoate 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:

: 106-25-2
Nerol

: 2051-49-2
n-hexanoic anhydride

: 10032-02-7
geraniol hexanoate

: 68310-59-8
(Z)-3,7-dimethyl-2,6-octadienyl ester hexanoic acid

Guidance literature:: With lipase from hog pancreas; In diethyl ether; at 20 ℃; Product distribution; Rate constant; also with other lipases; other solvents;
DOI:10.1016/S0040-4039(00)97757-8