[1,1'-Biphenyl]-2,5-diol, 2'-chloro-

Base Information

• Chemical Name: [1,1'-Biphenyl]-2,5-diol, 2'-chloro-
• CAS No.: 117-71-5
• Molecular Formula: C12H9 Cl O2
• Molecular Weight: 220.655
• Hs Code.: 2907299090
• European Community (EC) Number: 204-205-8
• DSSTox Substance ID: DTXSID4059461
• Nikkaji Number: J193.622K
• Wikidata: Q81988809
• Mol file: 117-71-5.mol

Synonyms:117-71-5;2-(2-chlorophenyl)benzene-1,4-diol;[1,1'-Biphenyl]-2,5-diol, 2'-chloro-;2-(2-chlorophenyl)hydroquinone;(1,1'-Biphenyl)-2,5-diol, 2'-chloro-;EINECS 204-205-8;(o-Chlorophenyl)hydroquinone;2'-Chloro[1,1'-biphenyl]-2,5-diol;2'-Chloro-biphenyl-2,5-diol;2'-Chloro(1,1'-biphenyl)-2,5-diol;2/'-chloro[1,1/'-biphenyl]-2,5-diol;C12H9ClO2;2'-chlorobiphenyl-2,5-diol;SCHEMBL9446142;DTXSID4059461;2-chloro[1,1-biphenyl]-2,5-diol;2'-Chloro-[1,1'-biphenyl]-2,5-diol;2'-Chloro[1,1'-biphenyl]-2,5-diol #;LS-182483;J-018025;J-509018

Chemical Property of [1,1'-Biphenyl]-2,5-diol, 2'-chloro-

Chemical Property:

• Melting Point: 98.5 °C
• Boiling Point: 391.1°Cat760mmHg
• PKA: 10.00±0.43(Predicted)
• Flash Point: 190.3°C
• PSA: 40.46000
• Density: 1.349g/cm³
• LogP: 3.41820
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 220.0291072
• Heavy Atom Count: 15
• Complexity: 210

Purity/Quality:

97% ^*data from raw suppliers

2-(2-CHLOROPHENYL)HYDROQUINONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=C(C=CC(=C2)O)O)Cl

Technology Process of [1,1'-Biphenyl]-2,5-diol, 2'-chloro-

There total 3 articles about [1,1'-Biphenyl]-2,5-diol, 2'-chloro- 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: 81.0%

2-chlorobenzenediazonium tetrafluoroborate (1956-97-4) + hydroquinone (123-31-9,8027-02-9) → 2-(2'-chlorophenyl)-1,4-hydroquinone (117-71-5)

Guidance literature:

2-chlorobenzenediazonium tetrafluoroborate; hydroquinone; With hydrogenchloride; titanium(III) chloride; In water; acetonitrile; for 0.583333h;

With sodium hydroxide; sodium sulfite; In water;

DOI:10.1002/anie.200803785

Reference yield:

→ 2-(2'-chlorophenyl)-1,4-hydroquinone (117-71-5)

Guidance literature:

With sodium dithionite; water;

Reference yield:

→ 2-(2'-chlorophenyl)-1,4-hydroquinone (117-71-5)

Guidance literature:

entspr. Chinon, N,N-Diethylhydroxylamin;

DOI:10.1021/jo01329a012

upstream raw materials:

2-chlorobenzenediazonium tetrafluoroborate

hydroquinone

Downstream raw materials:

2-methoxy-1,3-dinitro-dibenzofuran

3-amino-2-methoxydibenzofuran

2-hydroxydibenzofuran

Refernces