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4-Amino-3-nitrobenzonitrile

CAS No.
6393-40-4
Chemical Name:
4-Amino-3-nitrobenzonitrile
Synonyms
BUTTPARK 96\04-65;4-Cyano-2-nitroaniline;2-Nitro-4-cyanoaniline;3-Nitro-4-Aminobenzonitrile;4-AMINO-3-NITROBENZONITRILE;Benzonitrile, 4-amino-3-nitro-;4-Amino-3-nitrobenzonitrile >4-Amino-3-nitrobenzonitrile,98%;4-AMINO-3-NITROBENZONITRILE 98%;4-AMino-3-nitrobenzonitrile, 97+%
CBNumber:
CB4675356
Molecular Formula:
C7H5N3O2
Molecular Weight:
163.13
MDL Number:
MFCD00013373
MOL File:
6393-40-4.mol
MSDS File:
SDS
Last updated:2025-07-24 18:13:53

4-Amino-3-nitrobenzonitrile Properties

Melting point 159-162 °C (lit.)
Boiling point 349.8±32.0 °C(Predicted)
Density 1.41±0.1 g/cm3(Predicted)
storage temp. Keep in dark place,Inert atmosphere,Room temperature
solubility Soluble in ethanol and benzene.
pka -3.52±0.10(Predicted)
form Powder, Crystals or Crystalline Powder
color Yellow
BRN 778939
InChI InChI=1S/C7H5N3O2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2
InChIKey JAHADAZIDZMHOP-UHFFFAOYSA-N
SMILES C(#N)C1=CC=C(N)C([N+]([O-])=O)=C1
CAS DataBase Reference 6393-40-4(CAS DataBase Reference)
UNSPSC Code 12352100
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi,Xn
Risk Statements  36/37/38-20/21/22
Safety Statements  26-36-36/37/39
RIDADR  3276
WGK Germany  3
Hazard Note  Irritant
HazardClass  6.1
PackingGroup  III
HS Code  29269090
NFPA 704
1
2 0

4-Amino-3-nitrobenzonitrile price More Price(33)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 324698 4-Amino-3-nitrobenzonitrile 98% 6393-40-4 5g $61.6 2023-06-20 Buy
TCI Chemical A2447 4-Amino-3-nitrobenzonitrile >98.0%(GC) 6393-40-4 5g $170 2025-07-31 Buy
TCI Chemical A2447 4-Amino-3-nitrobenzonitrile >98.0%(GC) 6393-40-4 25g $678 2025-07-31 Buy
TRC A618398 4-Amino-3-nitrobenzonitrile 6393-40-4 1g $55 2021-12-16 Buy
Frontier Specialty Chemicals JK156087 4-Amino-3-nitrobenzonitrile 98% 6393-40-4 5g $127 2021-12-16 Buy
Product number Packaging Price Buy
324698 5g $61.6 Buy
A2447 5g $170 Buy
A2447 25g $678 Buy
A618398 1g $55 Buy
JK156087 5g $127 Buy

4-Amino-3-nitrobenzonitrile Chemical Properties,Uses,Production

Chemical Properties

white to light yellow crystal powder

Uses

4-Amino-3-nitrobenzonitrile is used in gamma irradiations effect on release of this compound from polyanhydride matrixes.

Uses

Gamma irradiations effect on release of 4-amino-3-nitrobenzonitrile from polyanhydride matrixes.

Synthesis Reference(s)

Journal of Medicinal Chemistry, 36, p. 1746, 1993 DOI: 10.1021/jm00064a008

Synthesis

4-ACETAMIDOBENZONITRILE

35704-19-9

4-Amino-3-nitrobenzonitrile

6393-40-4

General procedure for the synthesis of 4-amino-3-nitrobenzonitrile from 4'-cyanoacetanilide: potassium nitrate (15.6 mmol) was dissolved in 8 mL of concentrated sulfuric acid and the mixture was cooled to below 0 °C. Under this cooling condition, 7.8 mmol of 4'-cyanoacetanilide was slowly added, keeping the reaction temperature at 0 °C for 3.5 hours. Upon completion of the reaction, the mixture was poured into an ice water bath and the resulting yellow solid was collected by filtration and washed with a small amount of cold water. Subsequently, the resulting product was suspended in 30 mL of 2 mol/L sulfuric acid solution and heated under reflux conditions for 3 hours. At the end of the reaction, the suspension was cooled to room temperature, and the yellow solid was again collected by filtration and washed with a small amount of cold water to finally obtain the target product 4-amino-3-nitrobenzonitrile in 74% yield.

References

[1] Journal of the Brazilian Chemical Society, 2018, vol. 29, # 6, p. 1304 - 1317
[2] Journal of the Chemical Society, 1950, p. 1722,1725
[3] Journal of Medicinal Chemistry, 1995, vol. 38, # 10, p. 1786 - 1792
[4] Australian Journal of Chemistry, 1994, vol. 47, # 2, p. 247 - 262
[5] Journal of Medicinal Chemistry, 1993, vol. 36, # 12, p. 1746 - 1753

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View Lastest Price from 4-Amino-3-nitrobenzonitrile manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
	4-Amino-3-nitrobenzonitrile pictures 2023-12-26 4-Amino-3-nitrobenzonitrile
6393-40-4
US $100.00-1.00 / KG 1KG 99% g-kg-tons, free sample is available Henan Fengda Chemical Co., Ltd
4-Amino-3-nitrobenzonitrile pictures 2021-07-13 4-Amino-3-nitrobenzonitrile
6393-40-4
US $15.00-10.00 / KG 1KG 99%+ HPLC Monthly supply of 1 ton Zhuozhou Wenxi import and Export Co., Ltd
4-Amino-3-nitrobenzonitrile pictures 2021-07-10 4-Amino-3-nitrobenzonitrile
6393-40-4
US $15.00-10.00 / KG 1KG 99%+ HPLC Monthly supply of 1 ton Zhuozhou Wenxi import and Export Co., Ltd
4-Cyano-2-nitroaniline, 2-Amino-5-cyanonitrobenzene 4-AMino-3-nitrobenzonitrile, 98% 5GR 4-AMino-3-nitrobenzonitrile, 97+% BUTTPARK 96\04-65 4-AMINO-3-NITROBENZONITRILE 3-Nitro-4-Aminobenzonitrile 2-Nitro-4-cyanoaniline 4-Cyano-2-nitroaniline 4-AMINO-3-NITROBENZONITRILE 98% 4-Amino-3-nitrobenzonitrile,98% 4-Amino-3-nitrobenzonitrile > Benzonitrile, 4-amino-3-nitro- 4-Amino-3-nitrobenzonitrile ISO 9001:2015 REACH 6393-40-4 C7H5N3O2 H2NC6H3NO2CN AMINE Cyanides/Nitriles Nitrogen Compounds Organic Building Blocks Building Blocks C6 to C7 Chemical Amines Amines Aromatic Nitriles Nitrile Aromatics C6 to C7 Cyanides/Nitriles Nitrogen Compounds