1,3,6-Heptatriene

Base Information

Chemical Name:1,3,6-Heptatriene
CAS No.:1002-27-3
Molecular Formula:C7H10
Molecular Weight:94.1564
Hs Code.:2901299090
Mol file:1002-27-3.mol

Synonyms:1,3,6-Heptatriene;(3E)-hepta-1,3,6-triene;1002-27-3;(3E)-1,3,6-Heptatriene;(3E)-1,3,6-Heptatriene #;CXHZYOISZDAYCU-FNORWQNLSA-N;AKOS006274621

Suppliers and Price of 1,3,6-Heptatriene

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 10 raw suppliers

Chemical Property of 1,3,6-Heptatriene

Chemical Property:

Vapor Pressure:40.9mmHg at 25°C
Boiling Point:101.2 °C at 760 mmHg
Flash Point:°C
PSA：0.00000
Density:0.736 g/cm³
LogP:2.30470
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:3
Exact Mass:94.078250319
Heavy Atom Count:7
Complexity:78

Purity/Quality:: 98%,99%, ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCC=CC=C
Isomeric SMILES:C=CC/C=C/C=C

Technology Process of 1,3,6-Heptatriene

There total 11 articles about 1,3,6-Heptatriene 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:

: 74-85-1
ethene

: 542-92-7,25568-84-7,7313-32-8
cyclopenta-1,3-diene

: 591-93-5
1,4-Pentadiene

: 1002-27-3
1,3,6-heptatriene

: 2235-12-3
1,3,5-hexatriene

: 44607-51-4
trans-1,3,6-heptatriene

: 1165952-92-0
cyclohexa-1,4-diene

: 106-99-0,130983-70-9,29406-96-0,9003-17-2
buta-1,3-diene

Guidance literature:: With tricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidine][benzylidene]ruthenium(II) dichloride; In toluene; at 25 ℃; for 12h; under 7500.75 Torr; Time; Catalytic behavior; Schlenk technique; Inert atmosphere;
DOI:10.1002/cctc.201801088

Reference yield:

: 102683-82-9
1,5-hexadienyl bromomethyl sulfone

: 1002-27-3
1,3,6-heptatriene

: 2196-23-8
1,3,5-heptatriene

Guidance literature:: With potassium tert-butylate; In tetrahydrofuran; tert-butyl alcohol; at -23 ℃; for 24h;
DOI:10.1021/ja00275a051

Reference yield:

: 592-42-7
1,5-Hexadien

: 1002-27-3
1,3,6-heptatriene

Guidance literature:: Multi-step reaction with 3 steps

1: 86 percent / CH₂Cl₂ / 0 °C

2: 97 percent / Et₃N / CH₂Cl₂

3: KO-t-Bu / tetrahydrofuran; 2-methyl-propan-2-ol / 24 h / -23 °C

With potassium tert-butylate; triethylamine; In tetrahydrofuran; dichloromethane; tert-butyl alcohol;
DOI:10.1021/ja00275a051