(E)-3-(But-1-enyl)phenol

Base Information

Chemical Name:(E)-3-(But-1-enyl)phenol
CAS No.:702660-55-7
Molecular Formula:C10H12 O
Molecular Weight:148.205
Hs Code.:
DSSTox Substance ID:DTXSID20600980
Wikidata:Q82497336
Mol file:702660-55-7.mol

Synonyms:(E)-3-(BUT-1-ENYL)PHENOL;702660-55-7;3-[(E)-but-1-enyl]phenol;SCHEMBL16167021;SCHEMBL16167025;DTXSID20600980;3-[(1E)-But-1-en-1-yl]phenol;A9276

Suppliers and Price of (E)-3-(But-1-enyl)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 6 raw suppliers

Chemical Property of (E)-3-(But-1-enyl)phenol

Chemical Property:

Vapor Pressure:0.005mmHg at 25°C
Refractive Index:1.584
Boiling Point:267.7°C at 760 mmHg
Flash Point:120.295°C
PSA：20.23000
Density:1.02g/cm³
LogP:2.81540
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:148.088815002
Heavy Atom Count:11
Complexity:129

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC=CC1=CC(=CC=C1)O
Isomeric SMILES:CC/C=C/C1=CC(=CC=C1)O

Technology Process of (E)-3-(But-1-enyl)phenol

There total 1 articles about (E)-3-(But-1-enyl)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: 44.7%

: 6228-47-3
n-propyltriphenylphosphonium bromide

: 100-83-4
meta-hydroxybenzaldehyde

: 702660-55-7
1-(3-hydroxyphenyl)but-1-ene

Guidance literature:: n-propyltriphenylphosphonium bromide; With n-butyllithium; In tetrahydrofuran; hexane;

meta-hydroxybenzaldehyde; In tetrahydrofuran; hexane;
DOI:10.1016/j.chemphyslip.2003.08.004

Reference yield: 95.8%

: 702660-55-7
1-(3-hydroxyphenyl)but-1-ene

: 4074-43-5
m-butyl phenol

Guidance literature:: With hydrogen; palladium on activated charcoal; In ethanol; at 20 ℃; ambient pressure;
DOI:10.1016/j.chemphyslip.2003.08.004

Reference yield:

: 702660-55-7
1-(3-hydroxyphenyl)but-1-ene

: 532966-06-6
2-hydroxy-4-n-butylbenzaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1.1: 95.8 percent / H₂ / Pd/C / ethanol / 20 °C / ambient pressure

2.1: ethylmagnesium bromide / diethyl ether / 16 h / 20 °C

2.2: 50.8 percent / hexamethylphosphoramide / benzene / Heating

With ethylmagnesium bromide; hydrogen; palladium on activated charcoal; In diethyl ether; ethanol;
DOI:10.1016/j.chemphyslip.2003.08.004