2,6-Dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one

Base Information

Chemical Name:2,6-Dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one
CAS No.:74827-87-5
Molecular Formula:C14H13NO
Molecular Weight:211.263
Hs Code.:
DSSTox Substance ID:DTXSID10504342

Synonyms:74827-87-5;2,6-Dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one;DTXSID10504342

Suppliers and Price of 2,6-Dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2,6-Dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:211.099714038
Heavy Atom Count:16
Complexity:358

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=NC2=CC=CC=C2)C=C(C1=O)C

Technology Process of 2,6-Dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one

There total 4 articles about 2,6-Dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one 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: 62.0%

: 527-61-7
2,6-dimethyl-1,4-benzoquinone

: 62-53-3
aniline

: 74827-87-5
2,6-dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one

Guidance literature:: With copper diacetate; acetic acid; In chlorobenzene; at 110 ℃; for 3h;
DOI:10.1021/acs.orglett.0c01929

Reference yield: 49.0%

: 74827-85-3
N-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)acetamide

: 62-53-3
aniline

: 74827-87-5
2,6-dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one

Guidance literature:: In dichloromethane; for 72h; Ambient temperature;
DOI:10.1021/jm00185a001

Reference yield:

: 13331-93-6
4-nitroso-2,6-xylenol

: 74827-87-5
2,6-dimethyl-4-(phenylimino)cyclohexa-2,5-dien-1-one

Guidance literature:: Multi-step reaction with 3 steps

1: 69 percent / PtO₂, H₂ / acetic acid / 2 h / Ambient temperature

2: 65 percent / Pb(OAc)4 / ethyl acetate / Ambient temperature

3: 49 percent / CH₂Cl₂ / 72 h / Ambient temperature

With lead(IV) acetate; platinum(IV) oxide; hydrogen; In dichloromethane; acetic acid; ethyl acetate;
DOI:10.1021/jm00185a001