Zingiberene

Base Information

Chemical Name:Zingiberene
CAS No.:495-60-3
Molecular Formula:C₁₅H₂₄
Molecular Weight:204.356
Hs Code.:
European Community (EC) Number:207-804-2
UNII:8XOC63EI5F
DSSTox Substance ID:DTXSID00197808
Nikkaji Number:J17.884E
Wikipedia:Zingiberene
Wikidata:Q4117486
Metabolomics Workbench ID:28237
Mol file:495-60-3.mol

Synonyms:zingiberene

Suppliers and Price of Zingiberene

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

TRC
α-Zingiberene
5mg
$ 1390.00

Medical Isotopes, Inc.
α-Zingiberene
5 mg
$ 650.00

ChemScene
Zingiberene ≥97.0%
5mg
$ 1200.00

American Custom Chemicals Corporation
(-)-ZINGIBERENE 95.00%
5MG
$ 495.39

Total 24 raw suppliers

Chemical Property of Zingiberene

Chemical Property:

Vapor Pressure:0.0112mmHg at 25°C
Boiling Point:270.7°Cat760mmHg
Flash Point:107.5°C
PSA：0.00000
Density:0.854g/cm³
LogP:4.89130
Storage Temp.:Amber Vial, -86°C Freezer, Under inert atmosphere
Solubility.:Chloroform (Slightly), Hexane (Slightly), Methanol (Slightly)
XLogP3:5.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:4
Exact Mass:204.187800766
Heavy Atom Count:15
Complexity:274

Purity/Quality:

99%, ^*data from raw suppliers

α-Zingiberene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CCC(C=C1)C(C)CCC=C(C)C
Isomeric SMILES:CC1=CC[C@@H](C=C1)[C@@H](C)CCC=C(C)C
Uses α-Zingiberene is a sesquiterpine found in leaf glandular trichomes that is currently being evaluated for its cytotoxicity towards human tumour cell lines.

Technology Process of Zingiberene

There total 7 articles about Zingiberene 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%

: 87680-39-5
(3S,6R,7S)-1,10-bisaboladien-3-ol

: 19888-22-3,20307-83-9,20489-36-5,26882-41-7,27461-50-3,32182-04-0,73744-93-1,109278-27-5
β-sesquiphellandrene

: 38738-45-3,107175-68-8,495-60-3
(-)-zingiberene

Guidance literature:: With pyridine; trichlorophosphate; at 0 - 25 ℃;
DOI:10.1021/np5003753

Reference yield: 35.0%

: 87680-38-4
(1R,4R)-1-methyl-4-[(S)-6-methylhept-5-en-2-yl]cyclohex-2-enol

: 19888-22-3,20307-83-9,20489-36-5,26882-41-7,27461-50-3,32182-04-0,73744-93-1,109278-27-5
β-sesquiphellandrene

: 38738-45-3,107175-68-8,495-60-3
(-)-zingiberene

Guidance literature:: With pyridine; trichlorophosphate; at 0 - 25 ℃;
DOI:10.1021/np5003753

Reference yield:

: 343239-55-4
4-[(1S)-1,5-dimethylhex-4-enyl]cyclohex-2-en-1-one

: 19888-22-3,20307-83-9,20489-36-5,26882-41-7,27461-50-3,32182-04-0,73744-93-1,109278-27-5
β-sesquiphellandrene

: 38738-45-3,107175-68-8,495-60-3
(-)-zingiberene

Guidance literature:: Multi-step reaction with 2 steps

1: chloro(1,5-cyclooctadiene)rhodium(I) dimer; (R)-2,2'-bis(diphenylphosphanyl)-1,1'-binaphthyl / tetrahydrofuran; n-heptane / 24 h / -5 - 2 °C / Inert atmosphere

2: pyridine; trichlorophosphate / 0 - 25 °C

With pyridine; chloro(1,5-cyclooctadiene)rhodium(I) dimer; (R)-2,2'-bis(diphenylphosphanyl)-1,1'-binaphthyl; trichlorophosphate; In tetrahydrofuran; n-heptane;
DOI:10.1021/np5003753