7-Octene-1,5-diol

Base Information

• Chemical Name: 7-Octene-1,5-diol
• CAS No.: 7310-51-2
• Molecular Formula: C8H16O2
• Molecular Weight: 144.21100
• DSSTox Substance ID: DTXSID90449101
• Nikkaji Number: J328.401H
• Mol file: 7310-51-2.mol

Synonyms:7-octene-1,5-diol;Oct-7-ene-1,5-diol;7310-51-2;SCHEMBL5868387;DTXSID90449101

Chemical Property of 7-Octene-1,5-diol

Chemical Property:

• PSA: 40.46000
• LogP: 1.08600
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 144.115029749
• Heavy Atom Count: 10
• Complexity: 81.3

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCC(CCCCO)O

Technology Process of 7-Octene-1,5-diol

There total 12 articles about 7-Octene-1,5-diol 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: 95.0%

5-hydroxypentanal (4221-03-8) + allyl bromide (106-95-6) → oct-7-ene-1,5-diol (7310-51-2)

Guidance literature:

With indium; In water; for 3h; Ambient temperature;

DOI:10.1016/0040-4039(91)85028-4

Reference yield: 91.0%

2-(prop-2-en-1-yloxy)oxane (69161-61-1,4203-49-0) → oct-7-ene-1,5-diol (7310-51-2)

Guidance literature:

With tributylphosphine; diethylzinc; palladium diacetate; In hexane; toluene; at 0 - 20 ℃;

DOI:10.1002/anie.200351182

Reference yield: 91.0%

allyl bromide (106-95-6) + 5-hydroxy pentanaloxime (60222-90-4) → oct-7-ene-1,5-diol (7310-51-2)

Guidance literature:

With hydrogenchloride; tin; titanium(III) chloride; water; In tetrahydrofuran; at 20 ℃;

DOI:10.1016/j.tet.2012.01.074

upstream raw materials:

tetrahydro-2H-2-pyranol

allyl bromide

allylmagnesium bromide

5-hydroxypentanal

Downstream raw materials:

C₁₅H₂₀O₃

Refernces

• 1、 Juan, Song,Hua, Zhi-Hao,Qi, Shen,Ji, Shun-Jun,Loh, Teck-Peng. "Indium trichloride-catalyzed indium-mediated allylation of dihydropyrans and dihydrofurans in water". . p. 829 - 830. Retrieved 2004.
• 2、 Lin, Mei-Huey,Lin, Long-Zhi,Chuang, Tsung-Hsun,Liu, Han-Jun. "One-pot sequential deoximation and allylation reactions of aldoximes in aqueous solution". experimental part. p. 2630 - 2635. Retrieved 2012/04/23.
• 3、 Christlbauer, Monika,Schieberle, Peter. "Evaluation of the key aroma compounds in beef and pork vegetable gravies a la chef by stable isotope dilution assays and aroma recombination experiments". experimental part. p. 13122 - 13130. Retrieved 2012/03/22.