2-(3-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione

Base Information

Chemical Name:2-(3-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione
CAS No.:75552-46-4
Molecular Formula:C₁₂H₇ClO₂
Molecular Weight:218.639
Hs Code.:
NSC Number:731223
DSSTox Substance ID:DTXSID50351716
Nikkaji Number:J761.615E
Wikidata:Q82128342
Mol file:75552-46-4.mol

Synonyms:2-(3-chlorophenyl)cyclohexa-2,5-diene-1,4-dione;75552-46-4;CBMicro_032151;MixCom6_001815;SCHEMBL3767108;DTXSID50351716;NSC731223;STK338100;2-(3-chlorophenyl)-1,4-benzoquinone;AKOS002286281;NSC-731223;BIM-0032201.P001

Suppliers and Price of 2-(3-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione

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
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Total 0 raw suppliers

Chemical Property of 2-(3-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione

Chemical Property:

PSA：34.14000
LogP:2.43140
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:218.0134572
Heavy Atom Count:15
Complexity:355

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)Cl)C2=CC(=O)C=CC2=O

Technology Process of 2-(3-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione

There total 5 articles about 2-(3-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione 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: 89.3%

: 63503-60-6
3-chlorophenylboronic acid

: 106-51-4
p-benzoquinone

: 75552-46-4
2-(3'-chlorophenyl)-1,4-benzoquinone

Guidance literature:: With iron sulfide; dipotassium peroxodisulfate; In dichloromethane; water; at 20 ℃; for 24h;
DOI:10.1039/c2cc35468c

Reference yield: 76.0%

: 17333-84-5
3-chlorobenzenediazonium

: 106-51-4
p-benzoquinone

: 75552-46-4
2-(3'-chlorophenyl)-1,4-benzoquinone

Guidance literature:: In water; for 3h;
DOI:10.1021/ja00288a035

Reference yield: 65.0%

: 63503-60-6
3-chlorophenylboronic acid

: 108-95-2,27073-41-2
phenol

: 75552-46-4
2-(3'-chlorophenyl)-1,4-benzoquinone

Guidance literature:: With Iron(III) nitrate nonahydrate; dipotassium peroxodisulfate; oxygen; potassium carbonate; In water; at 70 ℃; for 24h;
DOI:10.1002/adsc.201301084