5-Undecylbenzene-1,3-diol

Base Information

Chemical Name:5-Undecylbenzene-1,3-diol
CAS No.:34155-91-4
Molecular Formula:C17H28O2
Molecular Weight:264.408
Hs Code.:2907299090
DSSTox Substance ID:DTXSID70442190
Nikkaji Number:J132.868I
Wikidata:Q82259329
Metabolomics Workbench ID:75853
Mol file:34155-91-4.mol

Synonyms:5-undecylbenzene-1,3-diol;34155-91-4;5-Undecyl-1,3-benzenediol;5-undecylresorcinol;1,3-Benzenediol, 5-undecyl-;5-Undecylresorcin;Compound NP-014641;SCHEMBL2464812;DTXSID70442190;LMPK15030010;AKOS040735049

Suppliers and Price of 5-Undecylbenzene-1,3-diol

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
5-Undecylresorcinol
1g
$ 2420.00

TRC
5-Undecylresorcinol
10mg
$ 90.00

Total 5 raw suppliers

Chemical Property of 5-Undecylbenzene-1,3-diol

Chemical Property:

PSA：40.46000
LogP:5.17110
XLogP3:6.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:10
Exact Mass:264.208930132
Heavy Atom Count:19
Complexity:195

Purity/Quality:

98% ^*data from raw suppliers

5-Undecylresorcinol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCC1=CC(=CC(=C1)O)O
Uses 5-Undecylresorcinol and its analogs have been used for DNA cleavage and study the products obtained. They have also studied for the inhibitory activities against colon cancer cell growth and proteasome.

Technology Process of 5-Undecylbenzene-1,3-diol

There total 12 articles about 5-Undecylbenzene-1,3-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: 90.0%

: 34822-41-8
1,3-dimethoxy-5-undecylbenzene

: 34155-91-4
1,3-dihydroxy-5-undecylbenzene

Guidance literature:: With boron tribromide; In dichloromethane; at 0 - 20 ℃;
DOI:10.1021/jf302872a

Reference yield:

: 17049-50-2
n-decyl magnesium bromide

: 34155-91-4
1,3-dihydroxy-5-undecylbenzene

Guidance literature:: Multi-step reaction with 4 steps

1: 45 percent / tetrahydrofuran / -20 - 20 °C

2: 23 percent / 2N KOH / 2 h / Heating

3: 62 percent / Et₃SiH / trifluoroacetic acid / 24 h / 45 °C

4: 38 percent / BBr₃ / CH₂Cl₂ / -20 - 20 °C

With triethylsilane; potassium hydroxide; boron tribromide; In tetrahydrofuran; dichloromethane; trifluoroacetic acid;
DOI:10.1248/cpb.37.2431

Reference yield:

: 17213-57-9
3,5-dimethoxybenzoyl chloride

: 34155-91-4
1,3-dihydroxy-5-undecylbenzene

Guidance literature:: Multi-step reaction with 4 steps

1: 45 percent / tetrahydrofuran / -20 - 20 °C

2: 23 percent / 2N KOH / 2 h / Heating

3: 62 percent / Et₃SiH / trifluoroacetic acid / 24 h / 45 °C

4: 38 percent / BBr₃ / CH₂Cl₂ / -20 - 20 °C

With triethylsilane; potassium hydroxide; boron tribromide; In tetrahydrofuran; dichloromethane; trifluoroacetic acid;
DOI:10.1248/cpb.37.2431