3-[4-(3-Hydroxyphenyl)hexan-3-yl]phenol

Base Information

Chemical Name:3-[4-(3-Hydroxyphenyl)hexan-3-yl]phenol
CAS No.:68266-24-0
Molecular Formula:C18H22 O2
Molecular Weight:270.371
Hs Code.:
NSC Number:366211,297170
DSSTox Substance ID:DTXSID90987795
Nikkaji Number:J275.273E
ChEMBL ID:CHEMBL18268

Synonyms:1,2-diethyl-1,2-bis(3'-hydroxyphenyl)ethane;3,3'-HES;3,4-bis(3'-hydroxyphenyl)hexane;meso-3,4-bis(3'-hydroxyphenyl)hexane;metahexestrol;NSC 297170;NSC 297170, (R*,R*)-(+-)-isomer;NSC 297170, (R*,S*)-isomer;NSC-297170

Suppliers and Price of 3-[4-(3-Hydroxyphenyl)hexan-3-yl]phenol

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 4 raw suppliers

Chemical Property of 3-[4-(3-Hydroxyphenyl)hexan-3-yl]phenol

Chemical Property:

XLogP3:5.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:270.161979940
Heavy Atom Count:20
Complexity:251

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C1=CC(=CC=C1)O)C(CC)C2=CC(=CC=C2)O

Technology Process of 3-[4-(3-Hydroxyphenyl)hexan-3-yl]phenol

There total 10 articles about 3-[4-(3-Hydroxyphenyl)hexan-3-yl]phenol 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: 91.0%

: 68266-30-8
metahexestrol dimethyl ether

: 68266-24-0
d,l-1,2-diethyl-1,2-bis(3'-hydroxyphenyl)ethane

Guidance literature:: With pyridine hydrochloride; at 220 ℃;
DOI:10.1021/jm00142a014

Reference yield:

: 37951-49-8
1-(3-methoxyphenyl)propan-1-one

: 68266-24-0
d,l-1,2-diethyl-1,2-bis(3'-hydroxyphenyl)ethane

Guidance literature:: Multi-step reaction with 3 steps

1: 78 percent / Zn, TiCl₄ / dioxane / 4 h / 101 °C

2: 95 percent / H₂ / 10percent Pd/C / ethanol

3: 90 percent / BBr₃ / CH₂Cl₂ / 0.5 h / -60 °C

With hydrogen; boron tribromide; titanium tetrachloride; zinc; palladium on activated charcoal; In 1,4-dioxane; ethanol; dichloromethane;
DOI:10.1021/jm00371a004

Reference yield:

: 76473-05-7
C₂₀H₂₄O₂

: 68266-24-0
d,l-1,2-diethyl-1,2-bis(3'-hydroxyphenyl)ethane

Guidance literature:: Multi-step reaction with 2 steps

1: 95 percent / H₂ / 10percent Pd/C / ethanol

2: 90 percent / BBr₃ / CH₂Cl₂ / 0.5 h / -60 °C

With hydrogen; boron tribromide; palladium on activated charcoal; In ethanol; dichloromethane;
DOI:10.1021/jm00371a004