1-{4-[Methyl(phenyl)amino]buta-1,3-diyn-1-yl}cyclohexan-1-ol

Base Information

Chemical Name:1-{4-[Methyl(phenyl)amino]buta-1,3-diyn-1-yl}cyclohexan-1-ol
CAS No.:90235-55-5
Molecular Formula:C₁₇H₁₉NO
Molecular Weight:253.344
Hs Code.:
DSSTox Substance ID:DTXSID70530445
Wikidata:Q82401572

Synonyms:90235-55-5;DTXSID70530445;1-{4-[Methyl(phenyl)amino]buta-1,3-diyn-1-yl}cyclohexan-1-ol

Suppliers and Price of 1-{4-[Methyl(phenyl)amino]buta-1,3-diyn-1-yl}cyclohexan-1-ol

Supply Marketing:

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

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Chemical Property of 1-{4-[Methyl(phenyl)amino]buta-1,3-diyn-1-yl}cyclohexan-1-ol

Chemical Property:

XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:253.146664230
Heavy Atom Count:19
Complexity:415

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C#CC#CC1(CCCCC1)O)C2=CC=CC=C2

Technology Process of 1-{4-[Methyl(phenyl)amino]buta-1,3-diyn-1-yl}cyclohexan-1-ol

There total 3 articles about 1-{4-[Methyl(phenyl)amino]buta-1,3-diyn-1-yl}cyclohexan-1-ol 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: 70.0%

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 350244-59-6
C₁₁H₈LiN

: 90235-55-5
1-<4-(Methylphenylamino)-1,3-butadiinyl>-1-cyclohexanol

Guidance literature:: In diethyl ether; for 3h; Ambient temperature;

Reference yield:

: 82505-76-8
(3,4,4-Trichloro-N-methyl-N-phenyl-3-buten-1-inyl)amin

: 90235-55-5
1-<4-(Methylphenylamino)-1,3-butadiinyl>-1-cyclohexanol

Guidance literature:: Multi-step reaction with 2 steps

1: 1.6 N LiBu / diethyl ether; hexane / 1.5 h / Ambient temperature

2: 70 percent / diethyl ether / 3 h / Ambient temperature

With n-butyllithium; In diethyl ether; hexane;

Reference yield:

: 35954-01-9
lithium N-methylanilide

: 90235-55-5
1-<4-(Methylphenylamino)-1,3-butadiinyl>-1-cyclohexanol

Guidance literature:: Multi-step reaction with 3 steps

1: 66 percent

2: 1.6 N LiBu / diethyl ether; hexane / 1.5 h / Ambient temperature

3: 70 percent / diethyl ether / 3 h / Ambient temperature

With n-butyllithium; In diethyl ether; hexane;