3-Chloro-N-(4-methylphenyl)aniline

Base Information

Chemical Name:3-Chloro-N-(4-methylphenyl)aniline
CAS No.:113965-92-7
Molecular Formula:C13H12ClN
Molecular Weight:217.698
Hs Code.:
DSSTox Substance ID:DTXSID40548072
Nikkaji Number:J3.150.938F
Wikidata:Q82426663
Mol file:113965-92-7.mol

Synonyms:3-Chloro-N-(4-methylphenyl)aniline;113965-92-7;SCHEMBL7913356;DTXSID40548072

Suppliers and Price of 3-Chloro-N-(4-methylphenyl)aniline

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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price

Total 1 raw suppliers

Chemical Property of 3-Chloro-N-(4-methylphenyl)aniline

Chemical Property:

XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:217.0658271
Heavy Atom Count:15
Complexity:187

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 3-Chloro-N-(4-methylphenyl)aniline

There total 2 articles about 3-Chloro-N-(4-methylphenyl)aniline 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: 72.0%

: 106-49-0,12221-03-3
p-toluidine

: 36229-42-2
(3-chlorophenyl)magnesium bromide

: 2050-67-1
PCB 11

: 113965-92-7
N-(4-tolyl)-3-chloroaniline

Guidance literature:: p-toluidine; With n-butyllithium; dichloro(N,N,N’,N‘-tetramethylethylenediamine)zinc; In tetrahydrofuran; hexane; at 0 - 20 ℃; for 0.5h; Inert atmosphere; Schlenk technique;

(3-chlorophenyl)magnesium bromide; With 1,3-dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone; bis(acetylacetonate)nickel(II); 1,2-dichloro-2-methylpropane; In tetrahydrofuran; hexane; at 0 - 20 ℃; for 3h; Inert atmosphere; Schlenk technique;
DOI:10.1021/ol302688u

Reference yield: 2.0%

: 3296-06-8
1-azido-3-chlorobenzene

: 108-88-3,15644-74-3,16713-13-6
toluene

: 113965-94-9
(3-chloro-phenyl)-o-tolyl-amine

: 113965-92-7
N-(4-tolyl)-3-chloroaniline

: 108-42-9
3-chloro-aniline

Guidance literature:: With boron trifluoride diethyl etherate; at 60 ℃; for 12h;
DOI:10.1016/S0040-4039(00)95887-8

Reference yield: 26.0%

: 100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6
styrene

: 817-87-8
ethyl azidocarbonate

: 113965-92-7
N-(4-tolyl)-3-chloroaniline

: C₂₅H₂₆ClNO₂

Guidance literature:: With [4,4′-bis(1,1-dimethylethyl)-2,2′-bipyridine-N1,N1′]bis{3,5-difluoro-2-[5-(trifluoromethyl)-2-pyridinyl-κN]phenyl-κC}iridium(III) hexafluorophosphate; In acetonitrile; at -78 - 20 ℃; for 72h; Inert atmosphere; Irradiation;
DOI:10.1021/acs.orglett.1c02071