2-Allyl-4-chlorophenol

Base Information

Chemical Name:2-Allyl-4-chlorophenol
CAS No.:13997-73-4
Molecular Formula:C9H9ClO
Molecular Weight:168.623
Hs Code.:
European Community (EC) Number:237-797-1
NSC Number:1539
UNII:4MA4H6DQ3X
DSSTox Substance ID:DTXSID9074513
Nikkaji Number:J216.811A
Wikidata:Q72437197
Mol file:13997-73-4.mol

Synonyms:2-Allyl-4-chlorophenol;13997-73-4;2-allyl-4-chloro-phenol;4-Chloro-2-allylphenol;4-chloro-2-prop-2-enylphenol;4-chloro-2-(prop-2-en-1-yl)phenol;Phenol, 2-allyl-4-chloro-;Phenol, 4-chloro-2-(2-propenyl)-;4MA4H6DQ3X;Phenol, 4-chloro-2-(2-propen-1-yl)-;NSC 1539;NSC-1539;EINECS 237-797-1;AI3-39001;NSC1539;UNII-4MA4H6DQ3X;SCHEMBL2490536;DTXSID9074513;MFCD00045776;AKOS005353930;AC-4947;CS-0074767;FT-0724941;A21060;D73872;AS-871/43475838;F8883-0482

Suppliers and Price of 2-Allyl-4-chlorophenol

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

TRC
4-chloro-2-(prop-2-en-1-yl)phenol
2.5mg
$ 45.00

Biosynth Carbosynth
2-Allyl-4-chlorophenol
500 mg
$ 415.00

Biosynth Carbosynth
2-Allyl-4-chlorophenol
250 mg
$ 237.50

Biosynth Carbosynth
2-Allyl-4-chlorophenol
100 mg
$ 119.00

Biosynth Carbosynth
2-Allyl-4-chlorophenol
50 mg
$ 68.00

Biosynth Carbosynth
2-Allyl-4-chlorophenol
1 g
$ 719.00

American Custom Chemicals Corporation
2-ALLYL-4-CHLOROPHENOL 95.00%
5MG
$ 504.43

Total 33 raw suppliers

Chemical Property of 2-Allyl-4-chlorophenol

Chemical Property:

Appearance/Colour:white like or light brown crystalline powder
Vapor Pressure:0.0138mmHg at 25°C
Melting Point:48°C
Refractive Index:1.564
Boiling Point:250.3 °C at 760 mmHg
Flash Point:105.2 °C
PSA：20.23000
Density:1.169 g/cm³
LogP:2.77410
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:168.0341926
Heavy Atom Count:11
Complexity:136

Purity/Quality:

97% ^*data from raw suppliers

4-chloro-2-(prop-2-en-1-yl)phenol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCC1=C(C=CC(=C1)Cl)O

Technology Process of 2-Allyl-4-chlorophenol

There total 8 articles about 2-Allyl-4-chlorophenol 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: 93.0%

: 13997-70-1
1-allyloxy-4-chlorobenzene

: 13997-73-4
2-allyl-4-chlorophenol

Guidance literature:: at 220 - 240 ℃; for 2h;

Reference yield:

: 106-48-9,82344-39-6
4-chloro-phenol

: 13997-73-4
2-allyl-4-chlorophenol

Guidance literature:: Multi-step reaction with 2 steps

1: 83 percent / K₂CO₃ / acetonitrile / 1.5 h / Heating

2: 80 percent / 1-butyl-2,3-(trimethylene)imidazolium bistriflylimide / 0.03 h / 250 °C / microwave irradiation

With potassium carbonate; In acetonitrile; 2: Claisen rearrangement;
DOI:10.1016/j.tet.2007.08.060

Reference yield:

: 106-48-9,82344-39-6
4-chloro-phenol

: 107-05-1
3-chloroprop-1-ene

: 13997-73-4
2-allyl-4-chlorophenol

Guidance literature:: With 1.) K; zinc(II) chloride; Yield given. Multistep reaction; 1.) xylene, 3 h, reflux, 2.) 13 h, reflux;
DOI:10.1055/s-1981-29431