2-((Cyanomethyl)amino)benzoic acid

Base Information

Chemical Name:2-((Cyanomethyl)amino)benzoic acid
CAS No.:28354-19-0
Molecular Formula:C9H8 N2 O2
Molecular Weight:176.175
Hs Code.:
DSSTox Substance ID:DTXSID70879720
Nikkaji Number:J1.583.790J
Wikidata:Q82861829
Mol file:28354-19-0.mol

Synonyms:28354-19-0;2-((Cyanomethyl)amino)benzoic acid;BRN 3262774;2-(cyanomethylamino)benzoic acid;Benzoic acid, 2-((cyanomethyl)amino)-;2-14-00-00225 (Beilstein Handbook Reference);DTXSID70879720;BENZOIC ACID, O-CYANOMETHYLAMINO-

Suppliers and Price of 2-((Cyanomethyl)amino)benzoic acid

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 2-((Cyanomethyl)amino)benzoic acid

Chemical Property:

Vapor Pressure:3.5E-08mmHg at 25°C
Boiling Point:430.7°Cat760mmHg
Flash Point:214.3°C
Density:1.341g/cm³
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:176.058577502
Heavy Atom Count:13
Complexity:231

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-((Cyanomethyl)amino)benzoic acid

There total 23 articles about 2-((Cyanomethyl)amino)benzoic acid 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: 93.0%

: 693809-75-5
2-(cyanomethyl-amino)-benzoic acid cyanomethyl ester

: 28354-19-0
2-cyanomethylaminobenzoic acid

Guidance literature:: With sodium hydroxide; In water; acetone; for 15h;
DOI:10.1016/j.tetlet.2003.11.111

Reference yield: 76.0%

: 143-33-9,25596-52-5
sodium cyanide

: 693809-77-7
1-acetyl-1,2-dihydro-benzo[d][1,3]oxazin-4-one

: 28354-19-0
2-cyanomethylaminobenzoic acid

Guidance literature:: sodium cyanide; 1-acetyl-1,2-dihydro-benzo[d][1,3]oxazin-4-one; In dimethyl sulfoxide; at 80 ℃; for 18h;

With hydrogenchloride; In water; dimethyl sulfoxide; Further stages.;
DOI:10.1016/j.tetlet.2003.11.111