Cas no 101420-79-5 (4-Iodo-3-nitrobenzonitrile)
4-Iodo-3-nitrobenzonitrile is a halogenated aromatic compound featuring both nitro and cyano functional groups, making it a versatile intermediate in organic synthesis. Its iodine substituent provides a reactive site for cross-coupling reactions, such as Suzuki or Sonogashira couplings, while the electron-withdrawing nitro and cyano groups enhance its utility in nucleophilic substitution and cyclization reactions. This compound is particularly valuable in pharmaceutical and agrochemical research for constructing complex heterocycles or functionalized aromatics. Its high purity and stability under standard conditions ensure reliable performance in synthetic applications. The distinct reactivity profile of 4-Iodo-3-nitrobenzonitrile makes it a preferred choice for targeted molecular transformations.
4-Iodo-3-nitrobenzonitrile structure
Product Name:4-Iodo-3-nitrobenzonitrile
CAS No:101420-79-5
MF:C7H3IN2O2
MW:274.01539349556
MDL:MFCD07783655
CID:98072
PubChem ID:17838683
Update Time:2025-06-08
4-Iodo-3-nitrobenzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 4-Iodo-3-nitrobenzonitrile
- Benzonitrile,4-iodo-3-nitro-
- 1-Cyano-3-nitro-4-iodobenzene
- 4-iodo-3-nitro-benzonitrile
- 4-Jod-3-nitro-benzonitril
- ACMC-20a4pv
- AGN-PC-01MGBG
- CTK3J9779
- SureCN5358509
- 3-Nitro-4-iodo-benzonitrile
- 3-Nitro-4-iodobenzonitrile
- C7H3IN2O2
- Benzonitrile, 4-iodo-3-nitro-
- 0379AA
- LS10160
- FCH4919250
- OR400133
- AX8237546
- ST24023579
- CS-B0300
- AKOS015909772
- H54NU5E52X
- EN300-396511
- DTXSID70591197
- FT-0720805
- J-000388
- CL9325
- 101420-79-5
- MFCD07783655
- AS-46292
- A897169
- SCHEMBL5358509
- DTXCID80541961
- DB-058604
-
- MDL： MFCD07783655
- Inchi： 1S/C7H3IN2O2/c8-6-2-1-5(4-9)3-7(6)10(11)12/h1-3H
- InChI Key： PZAMZPVQVFOYHP-UHFFFAOYSA-N
- SMILES： IC1=CC=C(C#N)C=C1[N+](=O)[O-]
Computed Properties
- Exact Mass: 273.92349
- Monoisotopic Mass: 273.92392g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 229
- 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
- Topological Polar Surface Area: 69.6
- XLogP3: 2.1
Experimental Properties
- Color/Form: No data avaiable
- Density: 2.1±0.1 g/cm3
- Melting Point: No data available
- Boiling Point: 330.7±37.0 °C at 760 mmHg
- Flash Point: 153.8±26.5 °C
- Refractive Index: 1.687
- PSA: 66.93
- LogP: 2.59428
- Vapor Pressure: 0.0±0.7 mmHg at 25°C
4-Iodo-3-nitrobenzonitrile Security Information
- Signal Word：warning
- Hazard Statement： H303+H313+H333
-
Warning Statement：
P264Thoroughly clean after treatment
P280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective mask
P305If it enters the eyes
P351Rinse carefully with water for a few minutes
P338Remove the contact lens(If any)And easy to operate,Continue flushing
P337If eye irritation persists
P313Obtain medical advice/care - Safety Instruction： H303+H313+H333
- Storage Condition：Store at 4 ° C, -4 ° C is better
4-Iodo-3-nitrobenzonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A013033480-250mg |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | 97% | 250mg |
$489.60 | 2023-09-04 | |
| Alichem | A013033480-500mg |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | 97% | 500mg |
$855.75 | 2023-09-04 | |
| Alichem | A013033480-1g |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | 97% | 1g |
$1534.70 | 2023-09-04 | |
| Chemenu | CM162166-10g |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | 95% | 10g |
$408 | 2021-06-16 | |
| ChemScence | CS-B0300-1g |
4-iodo-3-nitrobenzonitrile |
101420-79-5 | 99.67% | 1g |
$39.0 | 2022-04-28 | |
| ChemScence | CS-B0300-5g |
4-iodo-3-nitrobenzonitrile |
101420-79-5 | 99.67% | 5g |
$111.0 | 2022-04-28 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | I858911-1g |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | ≥98% | 1g |
￥273.60 | 2022-01-10 | |
| Fluorochem | 220300-1g |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | 95% | 1g |
￡104.00 | 2022-03-01 | |
| Fluorochem | 220300-5g |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | 95% | 5g |
￡312.00 | 2022-03-01 | |
| Fluorochem | 220300-10g |
4-Iodo-3-nitrobenzonitrile |
101420-79-5 | 95% | 10g |
￡468.00 | 2022-03-01 |
4-Iodo-3-nitrobenzonitrile Suppliers
Amadis Chemical Company Limited
Gold Member
Audited Supplier
(CAS:101420-79-5)4-Iodo-3-nitrobenzonitrile
Order Number:A897169
Stock Status:in Stock
Quantity:25g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 11:58
Price ($):181.0
Email:[email protected]
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier
(CAS:101420-79-5)3-Nitro-4-iodo-benzonitrile
Order Number:JOX-122
Stock Status:in Stock
Quantity:25KG
Purity:98%
Pricing Information Last Updated:Tuesday, 15 July 2025 15:40
Price ($):
Email:[email protected]
4-Iodo-3-nitrobenzonitrile Related Literature
-
Guangyu Zhang,Simin Sun,Shili Hou,Jiaxi Xu Org. Biomol. Chem. 2022 20 5470
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