Trichodiene

Base Information

Chemical Name:Trichodiene
CAS No.:28624-60-4
Molecular Formula:C15H24
Molecular Weight:204.356
Hs Code.:
UNII:697ERP55B1
DSSTox Substance ID:DTXSID201318181
Nikkaji Number:J17.359B
Wikidata:Q27098264
Metabolomics Workbench ID:28278
ChEMBL ID:CHEMBL2251626
Mol file:28624-60-4.mol

Synonyms:trichodiene

Suppliers and Price of Trichodiene

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 Trichodiene

Chemical Property:

Vapor Pressure:0.0244mmHg at 25°C
Boiling Point:256.7°C at 760 mmHg
Flash Point:99.2°C
PSA：0.00000
Density:0.89g/cm³
LogP:4.86930
XLogP3:4.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:1
Exact Mass:204.187800766
Heavy Atom Count:15
Complexity:310

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CCC(CC1)(C)C2(CCCC2=C)C
Isomeric SMILES:CC1=CC[C@@](CC1)(C)[C@]2(CCCC2=C)C

Technology Process of Trichodiene

There total 18 articles about Trichodiene 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:

: 372-97-4,13058-04-3,25744-33-6,27248-37-9,27248-38-0,40716-68-5
farnesyl pyrophosphate

: 18794-84-8
(E)-β-farnesene

: 28624-60-4
trichodiene

: 135096-31-0
(+)-α-cuprenene

: (+)-(R)-isochamigrene

Guidance literature:: With Tris buffer pH 7.8; 2-hydroxyethanethiol; magnesium chloride; at 30 ℃; for 16h; Further byproducts given. Title compound not separated from byproducts; D₉₈E mutant of recombinant F_. sporotrichioides trichodiene synthase;
DOI:10.1021/ja961897w

Reference yield:

: 104762-26-7
(2-methyl-1-cyclopentenyl)methyl 4-methyl-3-cyclohexene-1-carboxylate

: 24493-43-4,28624-60-4,61505-17-7,76231-80-6,80784-16-3
(+/-)-bazzanene

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) LDA

2: LiAlH₄ / diethyl ether / 12 h / 25 °C

3: 1.) n-BuLi, N,N,N',N'-tetramethylethylenediamine / 1.) dimethoxyethane, hexane, 0 deg C, 5 min, 2.) dimethoxyethane, hexane, RT, 1 h

4: Li, t-BuOH, ethylamine / 2 h / 0 °C

With lithium aluminium tetrahydride; n-butyllithium; N,N,N,N,-tetramethylethylenediamine; lithium; ethylamine; tert-butyl alcohol; lithium diisopropyl amide; In diethyl ether;
DOI:10.1021/jo00373a032

Reference yield:

: 16695-95-7
(4'-methylcyclohex-3'-ene-1-'-yl)carbonyl chloride

: 24493-43-4,28624-60-4,61505-17-7,76231-80-6,80784-16-3
(+/-)-bazzanene

Guidance literature:: Multi-step reaction with 5 steps

1: 81 percent / pyridine / 12 h / Ambient temperature

2: 1.) LDA

3: LiAlH₄ / diethyl ether / 12 h / 25 °C

4: 1.) n-BuLi, N,N,N',N'-tetramethylethylenediamine / 1.) dimethoxyethane, hexane, 0 deg C, 5 min, 2.) dimethoxyethane, hexane, RT, 1 h

5: Li, t-BuOH, ethylamine / 2 h / 0 °C

With pyridine; lithium aluminium tetrahydride; n-butyllithium; N,N,N,N,-tetramethylethylenediamine; lithium; ethylamine; tert-butyl alcohol; lithium diisopropyl amide; In diethyl ether;
DOI:10.1021/jo00373a032