(E)-3-[4-[(E)-1-(4-hydroxyphenyl)-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid

Base Information

Chemical Name:(E)-3-[4-[(E)-1-(4-hydroxyphenyl)-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid
CAS No.:195611-82-6
Molecular Formula:C25H22O3
Molecular Weight:370.448
Hs Code.:
Nikkaji Number:J1.163.759K,J1.555.992F
Pharos Ligand ID:ZAXZ2DHG98G2
ChEMBL ID:CHEMBL195515
Mol file:195611-82-6.mol

Synonyms:GW 7604

Suppliers and Price of (E)-3-[4-[(E)-1-(4-hydroxyphenyl)-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid

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

AK Scientific
GW7604
100mg
$ 2415.00

AK Scientific
GW7604
50mg
$ 1440.00

AK Scientific
GW7604
10mg
$ 350.00

Total 10 raw suppliers

Chemical Property of (E)-3-[4-[(E)-1-(4-hydroxyphenyl)-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid

Chemical Property:

PSA：57.53000
LogP:5.85910
XLogP3:6.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:370.15689456
Heavy Atom Count:28
Complexity:554

Purity/Quality:

97% ^*data from raw suppliers

GW7604 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(=C(C1=CC=C(C=C1)C=CC(=O)O)C2=CC=C(C=C2)O)C3=CC=CC=C3
Isomeric SMILES:CC/C(=C(/C1=CC=C(C=C1)/C=C/C(=O)O)\C2=CC=C(C=C2)O)/C3=CC=CC=C3

Technology Process of (E)-3-[4-[(E)-1-(4-hydroxyphenyl)-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid

There total 7 articles about (E)-3-[4-[(E)-1-(4-hydroxyphenyl)-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid 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:

: 1371574-24-1
(E)-3-{4-[(E/Z)-1-(4-methoxyphenyl)-2-phenylbut-1-enyl]phenyl}acrylic acid

: 195611-82-6
(E)-3-(4-((E)-1-(4-hydroxyphenyl)-2-phenylbut-1-en-1-yl)phenyl)acrylic acid

: 361203-06-7
(E)-3-[4-((Z)-1-(4-hydroxyphenyl)-2-phenylbut-1-en-1-yl)phenyl]acrylic acid

Guidance literature:: With boron tribromide; In dichloromethane; at -78 - 20 ℃; for 3.75h; Overall yield = 60 %;
DOI:10.1021/acs.jmedchem.6b01917

Reference yield:

: C₂₆H₂₄O₃

: 195611-82-6
(E)-3-(4-((E)-1-(4-hydroxyphenyl)-2-phenylbut-1-en-1-yl)phenyl)acrylic acid

: 361203-06-7
(E)-3-[4-((Z)-1-(4-hydroxyphenyl)-2-phenylbut-1-en-1-yl)phenyl]acrylic acid

Guidance literature:: With sodium hydroxide; In water; at 1 ℃; Reflux;
DOI:10.1021/acs.jmedchem.6b01917

Reference yield:

: 100-66-3
methoxybenzene

: 195611-82-6
(E)-3-(4-((E)-1-(4-hydroxyphenyl)-2-phenylbut-1-en-1-yl)phenyl)acrylic acid

: 361203-06-7
(E)-3-[4-((Z)-1-(4-hydroxyphenyl)-2-phenylbut-1-en-1-yl)phenyl]acrylic acid

Guidance literature:: Multi-step reaction with 5 steps

1.1: aluminum (III) chloride / dichloromethane / 2.5 h / 0 - 20 °C

2.1: magnesium; iodine / tetrahydrofuran / 4 h / 20 - 60 °C / Inert atmosphere

2.2: 3 h / 20 °C / Inert atmosphere

2.3: 5 h / Reflux

3.1: potassium hexamethylsilazane / tetrahydrofuran; toluene / 0.25 h / 0 °C / Inert atmosphere

3.2: 20 h / -78 - 20 °C / Inert atmosphere

4.1: potassium hydroxide / tetrahydrofuran; ethanol / 24 h

5.1: boron tribromide / dichloromethane / 2 h / 0 °C

With aluminum (III) chloride; iodine; boron tribromide; potassium hexamethylsilazane; magnesium; potassium hydroxide; In tetrahydrofuran; ethanol; dichloromethane; toluene; 1.1: |Friedel-Crafts Acylation / 3.1: |Wittig-Horner Reaction / 3.2: |Wittig-Horner Reaction;
DOI:10.1016/j.ejmech.2020.112191