4,5-Dimethoxy-2-[(phenylmethyl)amino]benzeneacetonitrile

Base Information

Chemical Name:4,5-Dimethoxy-2-[(phenylmethyl)amino]benzeneacetonitrile
CAS No.:118671-04-8
Molecular Formula:C₁₇H₁₈N₂O₂
Molecular Weight:282.342
Hs Code.:
DSSTox Substance ID:DTXSID101200210

Synonyms:118671-04-8;4,5-Dimethoxy-2-[(phenylmethyl)amino]benzeneacetonitrile;DTXSID101200210

Suppliers and Price of 4,5-Dimethoxy-2-[(phenylmethyl)amino]benzeneacetonitrile

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

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Chemical Property of 4,5-Dimethoxy-2-[(phenylmethyl)amino]benzeneacetonitrile

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:282.136827821
Heavy Atom Count:21
Complexity:346

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=C(C=C(C(=C1)CC#N)NCC2=CC=CC=C2)OC

Technology Process of 4,5-Dimethoxy-2-[(phenylmethyl)amino]benzeneacetonitrile

There total 3 articles about 4,5-Dimethoxy-2-[(phenylmethyl)amino]benzeneacetonitrile 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:

: (4,5-Dimethoxy-2-{[1-phenyl-meth-(E)-ylidene]-amino}-phenyl)-acetonitrile

: 118671-04-8
4,5-dimethoxy-2-<(phenylmethyl)amino>benzeneacetonitrile

Guidance literature:: With hydrogenchloride; sodium cyanoborohydride; In methanol; Yield given; indicated by bromocresol;
DOI:10.1016/S0040-4020(01)86867-8

Reference yield:

: 50546-80-0
(2-amino-4,5-dimethoxy-phenyl)-acetonitrile

: 118671-04-8
4,5-dimethoxy-2-<(phenylmethyl)amino>benzeneacetonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: p-TosOH / benzene / 16 h / azeotropic removal of water

2: 3M HCl, NaCNBH₃ / methanol / indicated by bromocresol

With hydrogenchloride; sodium cyanoborohydride; toluene-4-sulfonic acid; In methanol; benzene;
DOI:10.1016/S0040-4020(01)86867-8

Reference yield:

: 100-52-7
benzaldehyde

: 118671-04-8
4,5-dimethoxy-2-<(phenylmethyl)amino>benzeneacetonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: p-TosOH / benzene / 16 h / azeotropic removal of water

2: 3M HCl, NaCNBH₃ / methanol / indicated by bromocresol

With hydrogenchloride; sodium cyanoborohydride; toluene-4-sulfonic acid; In methanol; benzene;
DOI:10.1016/S0040-4020(01)86867-8