4-(Aminomethyl)-3-chlorobenzonitrile

Base Information

Chemical Name:4-(Aminomethyl)-3-chlorobenzonitrile
CAS No.:182292-05-3
Molecular Formula:C₈H₇ClN₂*ClH
Molecular Weight:203.071
Hs Code.:
DSSTox Substance ID:DTXSID40399187
Wikidata:Q82201581
Mol file:182292-05-3.mol

Synonyms:4-(aminomethyl)-3-chlorobenzonitrile;182292-05-3;202521-97-9;2-CHLORO-4-CYANOBENZYLAMINE;2-Chloro-4-cyano-benzylamine;SCHEMBL2678910;DTXSID40399187;SZCSAPNAYCKVPE-UHFFFAOYSA-N;4-aminomethyl-3-chlorobenzonitrile;AKOS006278662;AB08368

Suppliers and Price of 4-(Aminomethyl)-3-chlorobenzonitrile

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
Packaging
price

TRC
4-(Aminomethyl)-3-chlorobenzonitrile
10mg
$ 45.00

Anichem
4-(AMINOMETHYL)-3-CHLOROBENZONITRILE >95%
1g
$ 450.00

Total 3 raw suppliers

Chemical Property of 4-(Aminomethyl)-3-chlorobenzonitrile

Chemical Property:

PSA：49.81000
LogP:2.37068
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:166.0297759
Heavy Atom Count:11
Complexity:172

Purity/Quality:

98%min ^*data from raw suppliers

4-(Aminomethyl)-3-chlorobenzonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1C#N)Cl)CN

Technology Process of 4-(Aminomethyl)-3-chlorobenzonitrile

There total 7 articles about 4-(Aminomethyl)-3-chlorobenzonitrile 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: 83.0%

: 549531-00-2
di-tert-butyl [2-chloro-4-cyanobenzylamino]dicarboxylate

: 182292-05-3
4-(aminomethyl)-3-chlorobenzonitrile hydrochloride

Guidance literature:: With hydrogenchloride; In methanol; diethyl ether; at 20 ℃; for 5h;
DOI:10.1016/j.bcp.2007.01.026

Reference yield: 51.0%

: 227093-96-1
4-azidomethyl-3-chlorobenzonitrile

: 182292-05-3
4-(aminomethyl)-3-chlorobenzonitrile hydrochloride

Guidance literature:: With hydrogenchloride; triphenylphosphine; In ethanol; water;

Reference yield:

: 21423-81-4
3-chloro-4-methylbenzonitrile

: 182292-05-3
4-(aminomethyl)-3-chlorobenzonitrile hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1.1: N-bromosuccinimide; benzoyl peroxide / CCl₄ / 8 h / Heating

1.2: 52 percent / sodium hydride / tetrahydrofuran / 8 h / 0 - 20 °C

2.1: 83 percent / HCl / methanol; diethyl ether / 5 h / 20 °C

With hydrogenchloride; N-Bromosuccinimide; dibenzoyl peroxide; In methanol; tetrachloromethane; diethyl ether;
DOI:10.1016/j.bcp.2007.01.026