4-(Cyanoamino)benzoic acid

Base Information

Chemical Name:4-(Cyanoamino)benzoic acid
CAS No.:61700-58-1
Molecular Formula:C8H6 N2 O2
Molecular Weight:162.15
Hs Code.:2924299090
European Community (EC) Number:891-166-0
Mol file:61700-58-1.mol

Synonyms:61700-58-1;4-(cyanoamino)benzoic acid;4-Cyanamidobenzoic acid;4-CYANAMINOBENZOIC ACID;BENZOIC ACID,4-(CYANOAMINO)-;4-Cyanamidobenzoicacid;4-carboxyphenyl cyanamide;SCHEMBL7287581;OJXNIYRRNNEFEB-UHFFFAOYSA-N;AKOS006287255;SB75988;EN300-179503

Suppliers and Price of 4-(Cyanoamino)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
Packaging
price

TRC
4-(cyanoamino)benzoicacid
100mg
$ 285.00

TRC
4-(cyanoamino)benzoicacid
10mg
$ 45.00

American Custom Chemicals Corporation
4-CYANAMINOBENZOICACID 95.00%
1G
$ 770.70

American Custom Chemicals Corporation
4-CYANAMINOBENZOICACID 95.00%
5MG
$ 424.00

Total 9 raw suppliers

Chemical Property of 4-(Cyanoamino)benzoic acid

Chemical Property:

PSA：73.12000
LogP:1.35078
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:162.042927438
Heavy Atom Count:12
Complexity:210

Purity/Quality:

98%Min ^*data from raw suppliers

4-(cyanoamino)benzoicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C(=O)O)NC#N

Technology Process of 4-(Cyanoamino)benzoic acid

There total 3 articles about 4-(Cyanoamino)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: 74.0%

: 78190-05-3
4-(1H-1,2,3,4-tetrazol-1-yl)benzoic acid

: 61700-58-1
4-(cyanoamino)benzoic acid

Guidance literature:: With potassium hydroxide; dimethyl sulfoxide; In ethanol;
DOI:10.1007/s10593-005-0267-4

Reference yield:

: 150-13-0,159246-81-8,8014-65-1
4-amino-benzoic acid

: 61700-58-1
4-(cyanoamino)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 91 percent / NaN₃; AcOH / 80 - 95 °C

2: 74 percent / aq. KOH; DMSO / ethanol

With potassium hydroxide; sodium azide; acetic acid; dimethyl sulfoxide; In ethanol;
DOI:10.1007/s10593-005-0267-4