4-Nitrobenzonitrile

Base Information

Chemical Name:4-Nitrobenzonitrile
CAS No.:619-72-7
Molecular Formula:C7H4N2O2
Molecular Weight:148.121
Hs Code.:H4N2O2 MOL WT. 148.12
European Community (EC) Number:210-610-0
NSC Number:5383
UNII:4QKT535WUA
DSSTox Substance ID:DTXSID7060706
Nikkaji Number:J47.813J
Wikidata:Q63398003
Mol file:619-72-7.mol

Synonyms:4-nitrobenzonitrile

Suppliers and Price of 4-Nitrobenzonitrile

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-Nitrobenzonitrile
50g
$ 75.00

TCI Chemical
4-Nitrobenzonitrile >98.0%(GC)
25g
$ 35.00

TCI Chemical
4-Nitrobenzonitrile >98.0%(GC)
250g
$ 194.00

Sigma-Aldrich
4-Nitrobenzonitrile 97%
25g
$ 56.20

Oakwood
4-Nitrobenzonitrile 97%
100g
$ 80.00

Oakwood
4-Nitrobenzonitrile 97%
25g
$ 28.00

Oakwood
4-Nitrobenzonitrile 97%
5g
$ 16.00

Oakwood
4-Nitrobenzonitrile 97%
1g
$ 11.00

Frontier Specialty Chemicals
4-Nitrobenzonitrile 97%
25g
$ 57.00

Frontier Specialty Chemicals
4-Nitrobenzonitrile 97%
100g
$ 183.00

Total 132 raw suppliers

Chemical Property of 4-Nitrobenzonitrile

Chemical Property:

Appearance/Colour:white to light yellow crystal powder
Melting Point:144-147 °C(lit.)
Refractive Index:1.5300 (estimate)
Boiling Point:307.7 °C at 760 mmHg
Flash Point:139.9 °C
PSA：69.61000
Density:1.31 g/cm³
LogP:1.98968
Storage Temp.:Store below +30°C.
Solubility.:1.65g/l slightly soluble
XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:148.027277375
Heavy Atom Count:11
Complexity:192

Purity/Quality:

99%, ^*data from raw suppliers

4-Nitrobenzonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:T
Statements: 23/24/25-36/37/38
Safety Statements: 36/37/39-45-28A-36/37-22-26

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C#N)[N+](=O)[O-]

Technology Process of 4-Nitrobenzonitrile

There total 342 articles about 4-Nitrobenzonitrile 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: 98.0%

: 7409-30-5
p-nitrobenzylamine

: 619-72-7
4-nitrobenzonitrile

Guidance literature:: With ammonium hydroxide; 1,3-Diiodo-5,5-dimethyl-2,4-imidazolidinedione; at 60 ℃; for 4h;
DOI:10.1055/s-2007-967954

Reference yield: 98.0%

: 586-78-7
para-nitrophenyl bromide

: potassium ferrocyanide

: 619-72-7
4-nitrobenzonitrile

Guidance literature:: With sodium carbonate; In N,N-dimethyl-formamide; at 120 ℃; for 3h; Schlenk technique;
DOI:10.1016/j.carbpol.2020.116105

Reference yield: 97.0%

: 1129-37-9,174848-02-3,20707-69-1
4-nitrobenzaldehyde oxime

: 619-72-7
4-nitrobenzonitrile

Guidance literature:: With acetic anhydride; acetic acid; at 110 ℃; for 4h; chemoselective reaction; Inert atmosphere;
DOI:10.1055/s-0040-1708007