Phenol, p-(7-(2-(dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)-

Base Information

Chemical Name:Phenol, p-(7-(2-(dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)-
CAS No.:85850-80-2
Molecular Formula:C₂₆H₂₇NO₃
Molecular Weight:401.505
Hs Code.:
UNII:B81ZN098F2
DSSTox Substance ID:DTXSID60235119
ChEMBL ID:CHEMBL15081

Synonyms:BRN 5631037;B81ZN098F2;Phenol, p-(7-(2-(dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)-;p-(7-(2-(Dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)phenol;UNII-B81ZN098F2;85850-80-2;3-(2-(Dimethylamino)ethoxy)-10-ethyl-11-(4-hydroxyphenyl)dibenz(b,f)oxepin;CHEMBL15081;DTXSID60235119;LS-104436;PHENOL, 4-(7-(2-(DIMETHYLAMINO)ETHOXY)-11-ETHYLDIBENZ(B,F)OXEPIN-10-YL)-

Suppliers and Price of Phenol, p-(7-(2-(dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Phenol, p-(7-(2-(dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)-

Chemical Property:

Vapor Pressure:1.12E-12mmHg at 25°C
Boiling Point:549.3°Cat760mmHg
Flash Point:286°C
Density:1.163g/cm³
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:401.19909372
Heavy Atom Count:30
Complexity:581

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCC1=C(C2=C(C=C(C=C2)OCCN(C)C)OC3=CC=CC=C31)C4=CC=C(C=C4)O

Technology Process of Phenol, p-(7-(2-(dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)-

There total 11 articles about Phenol, p-(7-(2-(dimethylamino)ethoxy)-11-ethyldibenz(b,f)oxepin-10-yl)- 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:

: 819060-11-2
7-(2-Dimethylamino-ethoxy)-11-ethyl-10-[4-(tetrahydro-pyran-2-yloxy)-phenyl]-10,11-dihydro-dibenzo[b,f]oxepin-10-ol

: 85850-80-2
3-[-2-(dimethylamino)ethoxy]-10-ethyl-11-(4-hydroxyphenyl)dibenz[b,f]oxepin

Guidance literature:: With hydrogenchloride; In ethanol; for 1h; Yield given; Heating;
DOI:10.1021/jm00362a009

Reference yield:

: 36603-49-3
4-(tetrahydropyran-2'-yloxy)-1-bromobenzene

: 85850-80-2
3-[-2-(dimethylamino)ethoxy]-10-ethyl-11-(4-hydroxyphenyl)dibenz[b,f]oxepin

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) BuLi / 1.) THF, -70 deg C, 1 h, 2.) THF, RT, 18 h

2: conc. HCl / ethanol / 1 h / Heating

With hydrogenchloride; n-butyllithium; In ethanol;
DOI:10.1021/jm00362a009

Reference yield:

: 21905-75-9
2-carboxy-5'-methoxy-diphenyl ether

: 85850-80-2
3-[-2-(dimethylamino)ethoxy]-10-ethyl-11-(4-hydroxyphenyl)dibenz[b,f]oxepin

Guidance literature:: Multi-step reaction with 10 steps

1: 97 percent / LiAlH₄ / diethyl ether; tetrahydrofuran / 4 h / Heating

2: thionyl chloride / toluene / 1 h / 80 °C

3: ethanol; H₂O / 12 h / Heating

4: 76 percent / aq. KOH / ethanol / 3 h / Heating

5: 83 percent / polyphosphoric acid / toluene / 4 h / Heating

6: 95 percent / tetrabutylammonium hydrogen sulfate, aq. NaOH / CH₂Cl₂ / 0.5 h

7: 58 percent / pyridine hydrochloride / 0.5 h / 210 °C

8: 60 percent / K₂CO₃ / acetone; dimethylformamide / 18 h / Heating

9: 1.) BuLi / 1.) THF, -70 deg C, 1 h, 2.) THF, RT, 18 h

10: conc. HCl / ethanol / 1 h / Heating

With hydrogenchloride; potassium hydroxide; sodium hydroxide; lithium aluminium tetrahydride; n-butyllithium; thionyl chloride; PPA; tetra(n-butyl)ammonium hydrogensulfate; pyridine hydrochloride; potassium carbonate; In tetrahydrofuran; diethyl ether; ethanol; dichloromethane; water; N,N-dimethyl-formamide; acetone; toluene;
DOI:10.1021/jm00362a009