4-Chloro-2-formylbenzeneacetonitrile

Base Information

Chemical Name:4-Chloro-2-formylbenzeneacetonitrile
CAS No.:135737-15-4
Molecular Formula:C₉H₆ClNO
Molecular Weight:179.606
Hs Code.:
DSSTox Substance ID:DTXSID701291039
Nikkaji Number:J434.442A

Synonyms:4-Chloro-2-formylbenzeneacetonitrile;SCHEMBL14330646;DTXSID701291039;135737-15-4

Suppliers and Price of 4-Chloro-2-formylbenzeneacetonitrile

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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-Chloro-2-formylbenzeneacetonitrile

Chemical Property:

XLogP3:1.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:179.0137915
Heavy Atom Count:12
Complexity:208

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=C(C=C1Cl)C=O)CC#N

Technology Process of 4-Chloro-2-formylbenzeneacetonitrile

There total 5 articles about 4-Chloro-2-formylbenzeneacetonitrile 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: 80.0%

: 135737-10-9
(5-Chloro-2-cyanomethyl-phenyl)-dimethylamino-acetonitrile

: 135737-15-4
2-(4-chloro-2-formylphenyl)acetonitrile

Guidance literature:: With copper(II) sulfate; In ethanol; water; for 0.166667h; Heating;
DOI:10.1021/jo00024a042

Reference yield:

: 104-88-1
4-chlorobenzaldehyde

: 135737-15-4
2-(4-chloro-2-formylphenyl)acetonitrile

Guidance literature:: Multi-step reaction with 3 steps

1: 70 percent / methanol; H₂O

2: 85 percent

3: 1.) K₂CO₃, 2.) CuSO₄*5H₂O / 1.) DMF, 0 deg C, 2 h, 2.) EtOH, H₂O, 10 min, reflux

With potassium carbonate; copper(II) sulfate; In methanol; water;
DOI:10.1021/jo00024a042

Reference yield:

: 135737-05-2
(4-Chloro-phenyl)-(cyanomethyl-methyl-amino)-acetonitrile

: 135737-15-4
2-(4-chloro-2-formylphenyl)acetonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: 85 percent

2: 1.) K₂CO₃, 2.) CuSO₄*5H₂O / 1.) DMF, 0 deg C, 2 h, 2.) EtOH, H₂O, 10 min, reflux

With potassium carbonate; copper(II) sulfate;
DOI:10.1021/jo00024a042