1-(p-(beta-Diethylaminoethoxy)phenyl)-1,2-diphenylethylene

Base Information

• Chemical Name: 1-(p-(beta-Diethylaminoethoxy)phenyl)-1,2-diphenylethylene
• CAS No.: 19957-52-9
• Molecular Formula: C26H29NO
• Molecular Weight: 371.522
• Hs Code.: 2922299090
• European Community (EC) Number: 606-410-1
• Nikkaji Number: J134.898A
• Mol file: 19957-52-9.mol

Synonyms:1-(p-(beta-diethylaminoethoxy)phenyl)-1,2-diphenylethylene;E.I.P.W. 103;EIPW 103;EIPW 103 citrate;EIPW 103 monocitrate;EIPW-103

Chemical Property of 1-(p-(beta-Diethylaminoethoxy)phenyl)-1,2-diphenylethylene

Chemical Property:

• Boiling Point: 485.6±33.0 °C(Predicted)
• PKA: 9.60±0.25(Predicted)
• PSA: 12.47000
• Density: 1.052±0.06 g/cm3(Predicted)
• LogP: 5.99610
• Storage Temp.: Amber Vial, -20°C Freezer, Under inert atmosphere
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 6.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 371.224914549
• Heavy Atom Count: 28
• Complexity: 435

Purity/Quality:

98%Min ^*data from raw suppliers

DeschloroClomiphene(E/ZMixture) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCOC1=CC=C(C=C1)C(=CC2=CC=CC=C2)C3=CC=CC=C3
• Isomeric SMILES: CCN(CC)CCOC1=CC=C(C=C1)/C(=C/C2=CC=CC=C2)/C3=CC=CC=C3
• Uses: Clomiphene (C587025) analog, with estrogenic activity. Deschloro CloMiphene can be used in the preparation of antifertility agents. Clomiphene (C587025) analog, with estrogenic activity. Also used in the preparation of antifertility agents.

Technology Process of 1-(p-(beta-Diethylaminoethoxy)phenyl)-1,2-diphenylethylene

There total 7 articles about 1-(p-(beta-Diethylaminoethoxy)phenyl)-1,2-diphenylethylene 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:

1-{4-[2-(diethylamino)ethoxy]phenyl}-1,2-diphenylethanol → 2-{4-(1,2-diphenylethenyl)phenoxy}-N,N-diethylethanamine hydrochloride (19957-52-9)

Guidance literature:

With hydrogenchloride; In toluene; Dean-Stark; Reflux;

Reference yield:

C20H14FI + 2-(Diethylamino)ethanol (100-37-8) → 2-{4-(1,2-diphenylethenyl)phenoxy}-N,N-diethylethanamine hydrochloride (19957-52-9)

Guidance literature:

With potassium-t-butoxide; In toluene; at 100 ℃;

DOI:10.1021/acs.oprd.1c00366

Reference yield:

C20H14BrF + 2-(Diethylamino)ethanol (100-37-8) → 2-{4-(1,2-diphenylethenyl)phenoxy}-N,N-diethylethanamine hydrochloride (19957-52-9) + α-Brom-β-<4-(2-diaethylamino-aethoxy)-phenyl>-stilben (47616-84-2)

Guidance literature:

With potassium-t-butoxide; In toluene; at 100 ℃;

DOI:10.1021/acs.oprd.1c00366

upstream raw materials:

4-flourophenylmagnesium bromide

diphenyl acetylene

2-(Diethylamino)ethanol

Downstream raw materials:

clomifene citrate

clomiphene citrate

Refernces

• 1、 -. "PROCESS FOR THE PREPARATION OF CLOMIPHENE". Paragraph 0098; 0099; 0100. . Retrieved 2016/06/28.