3-(4-Fluorophenyl)-6-(trifluoromethyl)indan-1-ol

Base Information

Chemical Name:3-(4-Fluorophenyl)-6-(trifluoromethyl)indan-1-ol
CAS No.:85118-30-5
Molecular Formula:C₁₆H₁₂F₄O
Molecular Weight:296.264
Hs Code.:
European Community (EC) Number:285-684-0
DSSTox Substance ID:DTXSID501005519
Nikkaji Number:J309.749H
Mol file:85118-30-5.mol

Synonyms:85118-30-5;3-(4-Fluorophenyl)-6-(trifluoromethyl)indan-1-ol;EINECS 285-684-0;3-(4-fluorophenyl)-6-(trifluoromethyl)-2,3-dihydro-1H-inden-1-ol;C16H12F4O;DTXSID501005519;C16-H12-F4-O;3-(4-Fluorophenyl)-2,3-dihydro-6-trifluoromethyl-1H-inden-1-ol

Suppliers and Price of 3-(4-Fluorophenyl)-6-(trifluoromethyl)indan-1-ol

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 6 raw suppliers

Chemical Property of 3-(4-Fluorophenyl)-6-(trifluoromethyl)indan-1-ol

Chemical Property:

Vapor Pressure:1.35E-05mmHg at 25°C
Boiling Point:353.1°C at 760 mmHg
Flash Point:167.4°C
PSA：20.23000
Density:1.362g/cm³
LogP:4.41350
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:296.08242765
Heavy Atom Count:21
Complexity:362

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(C2=C(C1O)C=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)F

Technology Process of 3-(4-Fluorophenyl)-6-(trifluoromethyl)indan-1-ol

There total 5 articles about 3-(4-Fluorophenyl)-6-(trifluoromethyl)indan-1-ol 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: 75.0%

: 80272-38-4
3-(4-fluorophenyl)-6-(trifluoromethyl)indan-1-one

: 80272-85-1,85118-30-5
3-(4-fluorophenyl)-6-(trifluoromethyl)indan-1-ol

Guidance literature:: With sodium tetrahydroborate; In methanol; for 1h; Ambient temperature;
DOI:10.1021/jm00361a002

Reference yield:

: 85118-24-7
2-bromo-4-(trifluoromethyl)benzaldehyde

: 80272-85-1,85118-30-5
3-(4-fluorophenyl)-6-(trifluoromethyl)indan-1-ol

Guidance literature:: Multi-step reaction with 5 steps

1: 82 percent / piperidine / toluene / 0.5 h / Heating

2: 1.) Mg / 1.) ether, 2.) ether, toluene, reflux, 30 min

3: aq. H₂SO₄, CH₃COOH / 24 h / Heating

4: 82 percent / n-butyllithium / hexane; diethyl ether / 0.5 h / 0 °C

5: 75 percent / sodium borohydride / methanol / 1 h / Ambient temperature

With piperidine; sodium tetrahydroborate; n-butyllithium; sulfuric acid; magnesium; acetic acid; In methanol; diethyl ether; hexane; toluene;
DOI:10.1021/jm00361a002

Reference yield:

: 85118-34-9
ethyl 3-<2-bromo-4-(trifluoromethyl)phenyl>-2-cyano-2-propenoate

: 80272-85-1,85118-30-5
3-(4-fluorophenyl)-6-(trifluoromethyl)indan-1-ol

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) Mg / 1.) ether, 2.) ether, toluene, reflux, 30 min

2: aq. H₂SO₄, CH₃COOH / 24 h / Heating

3: 82 percent / n-butyllithium / hexane; diethyl ether / 0.5 h / 0 °C

4: 75 percent / sodium borohydride / methanol / 1 h / Ambient temperature

With sodium tetrahydroborate; n-butyllithium; sulfuric acid; magnesium; acetic acid; In methanol; diethyl ether; hexane;
DOI:10.1021/jm00361a002