1,3-Benzenediol, 4-((5-chloro-2-hydroxyphenyl)azo)-

Base Information

Chemical Name:1,3-Benzenediol, 4-((5-chloro-2-hydroxyphenyl)azo)-
CAS No.:4867-01-0
Molecular Formula:C12H9ClN2O3
Molecular Weight:264.668
Hs Code.:
European Community (EC) Number:225-473-2
DSSTox Substance ID:DTXSID7063631
Nikkaji Number:J262.503B
Mol file:4867-01-0.mol

Synonyms:4867-01-0;EINECS 225-473-2;1,3-Benzenediol, 4-((5-chloro-2-hydroxyphenyl)azo)-;1,3-Benzenediol, 4-[(5-chloro-2-hydroxyphenyl)azo]-;4-[(5-chloro-2-hydroxyphenyl)azo]resorcinol;C12H9ClN2O3;1,3-Benzenediol, 4-(2-(5-chloro-2-hydroxyphenyl)diazenyl)-;Benzene, 4-chloro-1-hydroxy-2-((2,4-dihydroxyphenyl)azo)-;4-((5-Chloro-2-hydroxyphenyl)azo)resorcinol;DTXSID7063631;SCHEMBL11694040;4-(5-chloro-2-hydroxyphenylazo)resorcinol;4-[(5-Chloro-2-hydroxyphenyl)azo]-1,3-benzenediol

Suppliers and Price of 1,3-Benzenediol, 4-((5-chloro-2-hydroxyphenyl)azo)-

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 5 raw suppliers

Chemical Property of 1,3-Benzenediol, 4-((5-chloro-2-hydroxyphenyl)azo)-

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:428.5°Cat760mmHg
PKA:7.90±0.43(Predicted)
Flash Point:213°C
PSA：85.41000
Density:1.47g/cm³
LogP:3.87220
XLogP3:3.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:264.0301698
Heavy Atom Count:18
Complexity:303

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1O)O)N=NC2=C(C=CC(=C2)Cl)O

Technology Process of 1,3-Benzenediol, 4-((5-chloro-2-hydroxyphenyl)azo)-

There total 2 articles about 1,3-Benzenediol, 4-((5-chloro-2-hydroxyphenyl)azo)- 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: 78.0%

: 95-85-2
2-hydroxy-5-chloro-aniline

: 108-46-3
recorcinol

: 4867-01-0
4-[(E)-(5-chloro-2-hydroxyphenyl)diazenyl]benzene-1,3-diol

Guidance literature:: 2-hydroxy-5-chloro-aniline; With hydrogenchloride; sodium nitrite; In water; at 0 - 5 ℃; for 0.5h;

recorcinol; With sodium acetate; In water; N,N-dimethyl-formamide; at 0 - 5 ℃; for 3h; pH=4 - 5;
DOI:10.1016/j.molstruc.2017.07.099

Reference yield:

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

: 4867-01-0
4-[(E)-(5-chloro-2-hydroxyphenyl)diazenyl]benzene-1,3-diol

Guidance literature:: With hydrogenchloride; sodium nitrite; anschliessende Reaktion mit Resorcin und wss.NaOH;
DOI:10.1039/jr9580002573

Reference yield: 54.0%

: 4867-01-0
4-[(E)-(5-chloro-2-hydroxyphenyl)diazenyl]benzene-1,3-diol

: 814-68-6,25189-84-8
acryloyl chloride

: 3-hydroxy-4-[(E)-(5-chloro-2-hydroxyphenyl)diazenyl]phenyl prop-2-enoat

Guidance literature:: 4-[(E)-(5-chloro-2-hydroxyphenyl)diazenyl]benzene-1,3-diol; With sodium; In tetrahydrofuran; at 20 ℃; for 24h; Inert atmosphere;

acryloyl chloride; In tetrahydrofuran; at 20 ℃; for 4h; Inert atmosphere;
DOI:10.1016/j.molstruc.2017.07.099