3-(4-Hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

Base Information

Chemical Name:3-(4-Hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one
CAS No.:90035-32-8
Molecular Formula:C16H14O2
Molecular Weight:238.286
Hs Code.:
European Community (EC) Number:689-038-2
DSSTox Substance ID:DTXSID10535691

Synonyms:90035-32-8;3-(4-Hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one;3-(4-Hydroxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-one;SCHEMBL10692675;DTXSID10535691;3-(4-HYDROXYPHENYL)-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE

Suppliers and Price of 3-(4-Hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

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
3-(4-Hydroxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-one
25mg
$ 880.00

Total 4 raw suppliers

Chemical Property of 3-(4-Hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

Chemical Property:

PSA：37.30000
LogP:3.30490
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:238.099379685
Heavy Atom Count:18
Complexity:304

Purity/Quality:

99.3% ^*data from raw suppliers

3-(4-Hydroxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-one ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(CC(=O)C2=CC=CC=C21)C3=CC=C(C=C3)O
Uses 3-(4-Hydroxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-one is an intermediate in synthesizing Flocoumafen-d4 (F401502), an isotope labelled Flocoumafen is a second generation anticoagulant rodenticide. Flocoumafen is extremely effective against strains of pest rodents resistant to conventional anticoagulants. Flocoumafen is highly toxic and is used strictly in sewers and indoors in some places such as UK.

Technology Process of 3-(4-Hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

There total 16 articles about 3-(4-Hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one 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: 93.0%

: 61696-79-5
3,4-dihydro-3-(4-methoxyphenyl)naphthalene-1(2H)-one

: 90035-32-8
3-(4-hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

Guidance literature:: With hydrogen bromide; acetic acid; for 6h; Heating;
DOI:10.1016/j.bmcl.2004.09.009

Reference yield:

: 1023-17-2
4-methoxyphenyl benzyl ketone

: 90035-32-8
3-(4-hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

Guidance literature:: Multi-step reaction with 5 steps

1: 97 percent / Zn; I₂ / benzene / 1 h / Heating

2: 90 percent / Et₃SiH; TFA; BF₃*Et₂O / CH₂Cl₂ / 8 h / Heating

3: 92 percent / aq. KOH / 8 h / Heating

4: 85 percent / polyphosphoric acid / 1 h / 80 °C

5: 93 percent / HBr; AcOH / 6 h / Heating

With triethylsilane; potassium hydroxide; PPA; boron trifluoride diethyl etherate; hydrogen bromide; iodine; acetic acid; trifluoroacetic acid; zinc; In dichloromethane; benzene; 1: Reformatsky reaction;
DOI:10.1016/j.bmcl.2004.09.009

Reference yield:

: 118806-78-3
3-(4-methoxyphenyl)-4-phenylbutanoic acid

: 90035-32-8
3-(4-hydroxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

Guidance literature:: Multi-step reaction with 2 steps

1: 85 percent / polyphosphoric acid / 1 h / 80 °C

2: 93 percent / HBr; AcOH / 6 h / Heating

With PPA; hydrogen bromide; acetic acid;
DOI:10.1016/j.bmcl.2004.09.009