Cas no 6319-40-0 (4-Bromo-3-nitrobenzoic acid)
4-Bromo-3-nitrobenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 4-Bromo-3-nitrobenzoic acid
- RARECHEM AH CK 0042
- 3-nitro-4-bromobenzoic acid
- 4-Bromo-3-nitro-benzoic acid
- 4-Brom-3-nitro-benzoesaeure
- Benzoic acid,4-bromo-3-nitro
- Benzoic acid, 4-bromo-3-nitro-
- RVCTZJVBWNFYRU-UHFFFAOYSA-N
- NSC31041
- zlchem 531
- PubChem2194
- KSC353S1B
- Benzoic acid, 4-bromo-3-nitro
- 4-Bromo-3-nitrobenzoic acid #
- ZLC0396
- ZERENEX E/0101076
- BCP27175
- STK286014
- CL8108
- BBL009321
- SBB058928
- 4-Bromo-3-nitrobenzoic aci
- AM20050045
- MFCD00272137
- NSC-31041
- SCHEMBL99875
- 4-Bromo-3-nitrobenzoic acid, 95%
- A8716
- SY012256
- DS-0490
- AKOS001054363
- FT-0601656
- Z55993015
- EN300-09133
- PS-6036
- CS-W010246
- B3689
- AC-26014
- 4-bromo 3-nitrobenzoic acid
- J-514749
- DTXSID40283355
- AG-670/32633024
- 6319-40-0
- DB-006718
-
- MDL: MFCD00272137
- Inchi: 1S/C7H4BrNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)
- InChI Key: RVCTZJVBWNFYRU-UHFFFAOYSA-N
- SMILES: BrC1C=CC(C(=O)O)=CC=1[N+](=O)[O-]
Computed Properties
- Exact Mass: 244.93200
- Monoisotopic Mass: 244.932
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 227
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.5
- Topological Polar Surface Area: 83.1
Experimental Properties
- Density: 2.0176 (rough estimate)
- Melting Point: 202.0 to 206.0 deg-C
- Boiling Point: 340.9℃ at 760 mmHg
- Flash Point: 160℃
- Refractive Index: 1.6200 (estimate)
- PSA: 83.12000
- LogP: 2.57870
4-Bromo-3-nitrobenzoic acid Security Information
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Symbol:
- Prompt:warning
- Signal Word:Warning
- Hazard Statement: H302
- Warning Statement: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Hazardous Material transportation number:NONH for all modes of transport
- WGK Germany:3
- Hazard Category Code: 22
- Safety Instruction: S26; S36/37/39
-
Hazardous Material Identification:
- Safety Term:26-36/37/39
- Risk Phrases:R36/37/38
- Storage Condition:2-8°C
4-Bromo-3-nitrobenzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | 724734-5G |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 95% | 5G |
¥542.82 | 2022-02-24 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | B804023-25g |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 97% | 25g |
668.00 | 2021-05-17 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B3689-5g |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 98.0%(GC&T) | 5g |
¥350.0 | 2022-05-30 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B3689-25g |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 98.0%(GC&T) | 25g |
¥1390.0 | 2022-05-30 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-GO983-1g |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 97% | 1g |
40CNY | 2021-05-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-GO983-5g |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 97% | 5g |
161CNY | 2021-05-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-GO983-25g |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 97% | 25g |
669CNY | 2021-05-10 | |
| Matrix Scientific | 072914-25g |
4-Bromo-3-nitrobenzoic acid, 95+% |
6319-40-0 | 95+% | 25g |
$130.00 | 2023-09-10 | |
| Matrix Scientific | 072914-100g |
4-Bromo-3-nitrobenzoic acid, 95+% |
6319-40-0 | 95+% | 100g |
$384.00 | 2023-09-10 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R001713-25g |
4-Bromo-3-nitrobenzoic acid |
6319-40-0 | 97% | 25g |
¥201 | 2024-05-22 |
4-Bromo-3-nitrobenzoic acid Suppliers
4-Bromo-3-nitrobenzoic acid Related Literature
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Taiki Kohiki,Yusuke Kato,Yusuke Nishikawa,Kazuko Yorita,Ikuko Sagawa,Masaya Denda,Tsubasa Inokuma,Akira Shigenaga,Kiyoshi Fukui,Akira Otaka Org. Biomol. Chem. 2017 15 5289
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Herbert Henry Hodgson,Herbert Greensmith Beard J. Chem. Soc. 1927 20
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3. 292. The rearrangement of o-hydroxysulphones. Part VFrederick Galbraith,Samuel Smiles J. Chem. Soc. 1935 1234
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Agustina La-Venia,Sebastián A. Testero,Mirta P. Mischne,Ernesto G. Mata Org. Biomol. Chem. 2012 10 2514
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J. Davoll,D. H. Laney J. Chem. Soc. 1960 314
Related Categories
- Solvents and Organic Chemicals Organic Compounds Benzenoids Benzene and substituted derivatives Nitrobenzoic acids and derivatives
- Solvents and Organic Chemicals Organic Compounds Benzenoids Benzene and substituted derivatives Benzoic acids and derivatives Nitrobenzoic acids and derivatives
- Solvents and Organic Chemicals Organic Compounds Acids/Esters
Additional information on 4-Bromo-3-nitrobenzoic acid
Introduction to 4-Bromo-3-nitrobenzoic acid (CAS No: 6319-40-0)
4-Bromo-3-nitrobenzoic acid, with the chemical formula C?H?BrNO?, is a versatile intermediate in organic synthesis and pharmaceutical research. This compound, identified by its CAS number 6319-40-0, has garnered significant attention in the scientific community due to its unique structural properties and potential applications in drug development. The presence of both bromine and nitro substituents makes it a valuable building block for further functionalization, enabling the synthesis of more complex molecules.
The< strong>4-bromo-3-nitrobenzoic acid molecule exhibits distinct electronic and steric characteristics that influence its reactivity. The bromine atom at the 4-position provides a site for nucleophilic substitution reactions, while the nitro group at the 3-position can participate in reduction or condensation reactions. These features make it particularly useful in constructing heterocyclic compounds and biologically active scaffolds.
In recent years, 4-bromo-3-nitrobenzoic acid has been explored in various pharmaceutical applications. Its derivatives have shown promise as intermediates in the synthesis of antimicrobial and anti-inflammatory agents. For instance, studies have demonstrated its role in developing novel compounds targeting bacterial resistance mechanisms. The nitro group can be reduced to an amine, which can then be further modified to introduce other pharmacophores, enhancing the therapeutic potential of the resulting molecules.
Moreover, 4-bromo-3-nitrobenzoic acid has found utility in materials science, particularly in the synthesis of organic semiconductors and dyes. The conjugated system formed by the aromatic ring and the nitro group contributes to its electron-withdrawing properties, making it suitable for applications in optoelectronic devices. Researchers have leveraged its reactivity to design polymers with tailored electronic properties, which could revolutionize the field of flexible electronics.
The< strong>CAS No: 6319-40-0 designation ensures that researchers can reliably identify and procure this compound for their experiments. Its stability under standard storage conditions makes it a convenient choice for laboratory-scale synthesis. Additionally, advances in synthetic methodologies have improved the efficiency of producing high-purity 4-bromo-3-nitrobenzoic acid, reducing costs and minimizing waste.
Recent research has also highlighted the compound's role in medicinal chemistry beyond antimicrobial applications. Studies suggest that derivatives of 4-bromo-3-nitrobenzoic acid may exhibit anticancer properties by interfering with key signaling pathways in tumor cells. The bromine substituent, in particular, has been shown to enhance binding affinity to certain protein targets, improving drug efficacy. These findings open new avenues for developing targeted therapies based on this scaffold.
In conclusion, 4-Bromo-3-nitrobenzoic acid (CAS No: 6319-40-0) is a multifaceted compound with broad applications in pharmaceuticals and materials science. Its unique structural features enable diverse chemical transformations, making it an indispensable tool for synthetic chemists. As research continues to uncover new uses for this compound, its importance in advancing scientific discovery is likely to grow.
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