Cas no 17601-94-4 (2-Amino-3-bromo-5-nitrobenzonitrile)

2-Amino-3-bromo-5-nitrobenzonitrile is a halogenated nitrile compound featuring both amino and nitro functional groups, making it a versatile intermediate in organic synthesis. Its molecular structure, incorporating bromine and nitro substituents, allows for selective reactivity in cross-coupling reactions, nucleophilic substitutions, and other transformations. The presence of the nitrile group further enhances its utility in heterocyclic chemistry, particularly in the synthesis of pharmaceuticals, agrochemicals, and specialty materials. This compound is valued for its high purity and stability under controlled conditions, ensuring consistent performance in demanding synthetic applications. Its well-defined reactivity profile makes it a preferred choice for researchers developing complex molecular architectures.
2-Amino-3-bromo-5-nitrobenzonitrile structure
17601-94-4 structure
Product Name:2-Amino-3-bromo-5-nitrobenzonitrile
CAS No:17601-94-4
MF:C7H4BrN3O2
MW:242.029560089111
MDL:MFCD00054185
CID:50808
Update Time:2025-06-10

2-Amino-3-bromo-5-nitrobenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-Amino-3-bromo-5-nitrobenzonitrile
    • 1-amino-2-cyano-4-nitro-6-bromobenzene
    • 2-amino-3-bromo-5-nitrobenzenecarbonitrile
    • 2-bromo-4-nitro-6-cyanoaniline
    • 2-bromo-6-cyano-4-nitroaniline
    • 2-cyano-4-nitro-6-bromoaniline
    • 6-bromo-2-cyano-4-nitroaniline
    • 2-Cyano-6-bromo-4-nitroaniline
    • 3-Bromo-5-nitroanthranilonitrile
    • 2-Cyan-4-nitro-6-bromoaniline
    • 6-Bromo-4-nitro-2-cyanoaniline
    • 2-amino-3-bromo-5-nitro-benzonitril
    • Benzonitrile, 2-amino-3-bromo-5-nitro-
    • 2-Amino-3-bromo-5-nitrobenzonitrile,98%
    • PubChem2331
    • 2-Amino-3-bromo-1-cyano-5-nitrobenzene
    • Cambridge id 5228140
    • KSC496G6H
    • Jsp003611
    • MUHLVSZIVTURCZ-UHFFFAOYSA-N
    • MDL: MFCD00054185
    • Inchi: 1S/C7H4BrN3O2/c8-6-2-5(11(12)13)1-4(3-9)7(6)10/h1-2H,10H2
    • InChI Key: MUHLVSZIVTURCZ-UHFFFAOYSA-N
    • SMILES: BrC1=CC(=CC(C#N)=C1N)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 240.94900
  • Monoisotopic Mass: 240.949
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 256
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 95.6
  • Surface Charge: 0
  • Tautomer Count: nothing

Experimental Properties

  • Color/Form: Yellowish needle or powder
  • Density: 1.8856 (rough estimate)
  • Melting Point: 189.0 to 193.0 deg-C
  • Boiling Point: 374.8 °C at 760 mmHg
  • Flash Point: 180.5 °C
  • Refractive Index: 1.6200 (estimate)
  • PSA: 95.63000
  • LogP: 2.91558
  • Solubility: Insoluble in water

2-Amino-3-bromo-5-nitrobenzonitrile Security Information

2-Amino-3-bromo-5-nitrobenzonitrile Customs Data

  • HS CODE:2942000000
  • Customs Data:

    China Customs Code:

    2942000000

2-Amino-3-bromo-5-nitrobenzonitrile Pricemore >>

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2-Amino-3-bromo-5-nitrobenzonitrile Production Method

2-Amino-3-bromo-5-nitrobenzonitrile Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
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(CAS:17601-94-4)2-Amino-3-bromo-5-nitrobenzonitrile
Order Number:1645574
Stock Status:in Stock
Quantity:Company Customization
Purity:98%
Pricing Information Last Updated:Monday, 14 April 2025 21:49
Price ($):discuss personally
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:17601-94-4)2-氰基-4-硝基-6-溴苯胺
Order Number:LE1645574
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:30
Price ($):discuss personally
Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:17601-94-4)2-Amino-3-bromo-5-nitrobenzonitrile
1645574
Purity:98%
Quantity:Company Customization
Price ($):Inquiry
Email
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:17601-94-4)2-氰基-4-硝基-6-溴苯胺
LE1645574
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email