beta-Farnesene, (6Z)-

Base Information

• Chemical Name: beta-Farnesene, (6Z)-
• CAS No.: 28973-97-9
• Molecular Formula: C15H24
• Molecular Weight: 204.356
• Hs Code.: 2901299090
• UNII: G7F9BVF1UR
• DSSTox Substance ID: DTXSID101017764
• Nikkaji Number: J101.612A
• Wikidata: Q27119785
• Metabolomics Workbench ID: 47117
• Mol file: 28973-97-9.mol

Synonyms:beta-farnesene

Chemical Property of beta-Farnesene, (6Z)-

Chemical Property:

• Vapor Pressure: 0.0101mmHg at 25°C
• Refractive Index: 1.47
• Boiling Point: 272.5°C at 760 mmHg
• Flash Point: 109.7°C
• PSA: 0.00000
• Density: 0.807g/cm³
• LogP: 5.20150
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 7
• Exact Mass: 204.187800766
• Heavy Atom Count: 15
• Complexity: 260

Purity/Quality:

99% ^*data from raw suppliers

(Z)-β-Farnesene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC(=CCCC(=C)C=C)C)C
• Isomeric SMILES: CC(=CCC/C(=C\CCC(=C)C=C)/C)C
• Uses: (Z)-β-Farnesene is a sesquiterpenes and an isomer of trans-β-Farnesene (F102465). (Z)-β-Farnesene can be isolated from Conyza sumatrensis.

Technology Process of beta-Farnesene, (6Z)-

There total 7 articles about beta-Farnesene, (6Z)- 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: 36.0%

cis-nerolidol (3790-78-1) → (E,Z)-α-farnesene (502-61-4,26560-14-5,28973-98-0,28973-99-1,97885-54-6,125037-13-0,21499-64-9) + (Z)-beta-Farnesene (28973-97-9) + (Z,Z)-α-farnesene (28973-99-1,21499-64-9)

Guidance literature:

With pyridine; trichlorophosphate; In dimethyl sulfoxide; at 160 ℃; for 0.0833333h;

DOI:10.1016/S0040-4039(01)90401-0

Reference yield:

(+/-)-nerolidol (7212-44-4) → (E)-β-farnesene (18794-84-8) + (E,E)-alpha-farnesene (502-61-4,21499-64-9) + (Z)-beta-Farnesene (28973-97-9) + (Z,Z)-α-farnesene (28973-99-1,21499-64-9)

Guidance literature:

With pyridine; trichlorophosphate; Title compound not separated from byproducts; 1) ice bath, 1 h; 2) rt, 12 h;

DOI:10.1021/ac960890u

Reference yield:

homogeranylmagnesium bromide (79857-97-9,79857-98-0,121741-32-0) + buta-2,3-dien-1-yl diethyl phosphate (89228-81-9) → 7,11-dimethyl-3-methylene-1,6,10-dodecatriene (18794-84-8,28973-97-9,77129-48-7)

Guidance literature:

In tetrahydrofuran; for 0.5h; Yield given; Ambient temperature;

DOI:10.1016/S0040-4020(01)88795-0

upstream raw materials:

homogeranylmagnesium bromide

buta-2,3-dien-1-yl diethyl phosphate

cis-nerolidol

3-methyl-2-butenylmagnesium chloride

Downstream raw materials:

C₃₀H₄₈

neosqualane

isosqualane

2,6,10,15,19,23-hexamethyltetracosane