Phenol, 3-(1-methylpropyl)-

Base Information

Chemical Name:Phenol, 3-(1-methylpropyl)-
CAS No.:3522-86-9
Molecular Formula:C10H14O
Molecular Weight:150.221
Hs Code.:2907199090
DSSTox Substance ID:DTXSID90883985
Nikkaji Number:J141.387B
ChEMBL ID:CHEMBL464393
Mol file:3522-86-9.mol

Synonyms:3-sec-Butylphenol;Phenol, 3-(1-methylpropyl)-;3-butan-2-ylphenol;3-(1-Methylpropyl)phenol;SCHEMBL97542;CHEMBL464393;SCHEMBL17399704;DTXSID90883985;CS-0254188;A823187;3-sec-butylphenol;Calcium dibutyryladenosine cyclophosphate

Suppliers and Price of Phenol, 3-(1-methylpropyl)-

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 15 raw suppliers

Chemical Property of Phenol, 3-(1-methylpropyl)-

Chemical Property:

Melting Point:46.81°C (estimate)
Refractive Index:1.5115 (estimate)
Boiling Point:239.4 °C at 760 mmHg
PKA:10.04±0.10(Predicted)
Flash Point:114.4 °C
PSA：37.30000
Density:0.972 g/cm³
LogP:3.15560
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:150.104465066
Heavy Atom Count:11
Complexity:111

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of Phenol, 3-(1-methylpropyl)-

There total 12 articles about Phenol, 3-(1-methylpropyl)- 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: 84.0%

: 1-(benzyloxy)-3-(butan-2-yl)benzene

: 3522-86-9
1-(2-methylpropyl)phenol

Guidance literature:: With palladium on activated charcoal; hydrogen; In methanol; at 20 ℃; for 2h;

Reference yield: 75.0%

: 6565-58-8
1-(2-methylpropyl)-3-methoxybenzene

: 3522-86-9
1-(2-methylpropyl)phenol

Guidance literature:: With lithium; ethylenediamine; In tetrahydrofuran; at 5 - 8 ℃;
DOI:10.1055/s-2004-815977

Reference yield: 66.0%

: 591-20-8
3-Bromophenol

: 598-30-1
sec.-butyllithium

: 3522-86-9
1-(2-methylpropyl)phenol

Guidance literature:: 3-Bromophenol; With bis(tri-tert-butylphosphine)palladium⁽⁰⁾; choline chloride; urea; In water; at 60 ℃; for 0.166667h; Schlenk technique;

sec.-butyllithium; With zinc(II) chloride; In 2-methyltetrahydrofuran; water; at 60 ℃; for 0.00555556h; chemoselective reaction; Schlenk technique;
DOI:10.1002/anie.202101571