Cas no 75996-29-1 (5-Fluorobenzene-1,3-diol)
5-Fluorobenzene-1,3-diol Chemical and Physical Properties
Names and Identifiers
-
- 5-Fluorobenzene-1,3-diol
- 5-Fluororesorcinol
- 5-FLUORO-BENZENE-1,3-DIOL
- 3,5-dihydroxyfluorobenzene
- 5-fluoro-3,5-dihydroxybenzene
- 1,3-Benzenediol, 5-fluoro-
- 1-Fluoro-3,5-dihydroxybenzene
- LYFBZGKZAZBANN-UHFFFAOYSA-N
- AK141992
- F1081
- DS-7470
- F52031
- DTXSID80505942
- AMY28235
- A928789
- CS-0146737
- MFCD08457182
- SCHEMBL972239
- Z1198179531
- 75996-29-1
- CHEMBL2332778
- AKOS006288247
- EN300-171230
- ZH0003
- DB-139815
-
- MDL: MFCD08457182
- Inchi: 1S/C6H5FO2/c7-4-1-5(8)3-6(9)2-4/h1-3,8-9H
- InChI Key: LYFBZGKZAZBANN-UHFFFAOYSA-N
- SMILES: FC1C=C(C=C(C=1)O)O
Computed Properties
- Exact Mass: 128.02700
- Monoisotopic Mass: 128.02735756g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 87.1
- 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: 0.6
- Topological Polar Surface Area: 40.5
Experimental Properties
- Density: 1.415±0.06 g/cm3 (20 oC 760 Torr),
- Melting Point: 136.0 to 140.0 deg-C
- Boiling Point: 237.9±10.0 oC (760 Torr),
- Flash Point: 97.7±19.0 oC,
- Solubility: Slightly soluble (6 g/l) (25 o C),
- PSA: 40.46000
- LogP: 1.23690
5-Fluorobenzene-1,3-diol Security Information
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Symbol:
- Prompt:warning
- Hazard Statement: H315-H319
- Warning Statement: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
5-Fluorobenzene-1,3-diol Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 037809-250mg |
5-Fluoro-benzene-1,3-diol |
75996-29-1 | 95% | 250mg |
£160.00 | 2022-03-01 | |
| Fluorochem | 037809-1g |
5-Fluoro-benzene-1,3-diol |
75996-29-1 | 95% | 1g |
£245.00 | 2022-03-01 | |
| Fluorochem | 037809-5g |
5-Fluoro-benzene-1,3-diol |
75996-29-1 | 95% | 5g |
£1051.00 | 2022-03-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | F156742-1g |
5-Fluorobenzene-1,3-diol |
75996-29-1 | >98.0%(GC) | 1g |
¥1030.90 | 2023-09-02 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | F156742-250mg |
5-Fluorobenzene-1,3-diol |
75996-29-1 | >98.0%(GC) | 250mg |
¥439.90 | 2023-09-02 | |
| Alichem | A014002841-1g |
5-Fluorobenzene-1,3-diol |
75996-29-1 | 95% | 1g |
$679.90 | 2023-09-01 | |
| Alichem | A014002841-5g |
5-Fluorobenzene-1,3-diol |
75996-29-1 | 95% | 5g |
$1852.50 | 2023-09-01 | |
| Chemenu | CM254937-1g |
5-Fluorobenzene-1,3-diol |
75996-29-1 | 95% | 1g |
$583 | 2021-06-16 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | F863934-250mg |
5-Fluororesorcinol |
75996-29-1 | >98.0%(GC) | 250mg |
¥1,064.70 | 2022-01-11 | |
| CHENG DOU FEI BO YI YAO Technology Co., Ltd. | FB00872-5g |
5-Fluorobenzene-1,3-diol |
75996-29-1 | 95% | 5g |
$1570 | 2023-09-07 |
5-Fluorobenzene-1,3-diol Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
Additional information on 5-Fluorobenzene-1,3-diol
Comprehensive Overview of 5-Fluorobenzene-1,3-diol (CAS No. 75996-29-1): Properties, Applications, and Industry Insights
5-Fluorobenzene-1,3-diol (CAS No. 75996-29-1), also known as 5-Fluoro-1,3-benzenediol, is a fluorinated aromatic compound with significant relevance in pharmaceutical, agrochemical, and material science research. This fluorophenol derivative features a hydroxyl group at the 1 and 3 positions of the benzene ring, combined with a fluorine substituent at the 5-position, which enhances its reactivity and utility in synthetic chemistry. The compound’s unique structure makes it a valuable intermediate for designing advanced bioactive molecules and functional materials.
In recent years, the demand for fluorinated building blocks like 5-Fluorobenzene-1,3-diol has surged due to their role in drug discovery. Researchers frequently search for "fluorophenol applications" or "CAS 75996-29-1 synthesis" to explore its potential in developing kinase inhibitors, antimicrobial agents, and PET radiotracers. The fluorine atom’s electronegativity improves metabolic stability and binding affinity, aligning with trends in precision medicine and targeted therapies.
From a technical perspective, 5-Fluorobenzene-1,3-diol exhibits a melting point of 98–102°C and solubility in polar organic solvents such as ethanol and dimethyl sulfoxide (DMSO). Its spectroscopic properties (e.g., NMR and IR data) are well-documented, aiding in quality control during industrial-scale production. Analytical techniques like HPLC and GC-MS are commonly employed to verify purity, a critical factor for end-users in the fine chemical industry.
Environmental and regulatory considerations are also pivotal. While not classified as hazardous under major chemical inventories, proper handling guidelines emphasize avoiding prolonged exposure. Sustainability-focused queries such as "green synthesis of fluorophenols" reflect growing interest in eco-friendly production methods for derivatives like 5-Fluorobenzene-1,3-diol. Innovations in catalytic fluorination and flow chemistry are addressing these demands.
Market analysts highlight the compound’s role in high-performance polymers and electronic materials, particularly in OLED manufacturing. Its ability to modify electron density in conjugated systems makes it attractive for organic semiconductors. Additionally, patents involving 5-Fluorobenzene-1,3-diol often cite its use in UV stabilizers and antioxidants, further diversifying its industrial footprint.
In summary, 5-Fluorobenzene-1,3-diol (CAS No. 75996-29-1) bridges multiple scientific disciplines, driven by its structural versatility and fluorine’s strategic advantages. As AI-driven drug discovery and smart materials evolve, this compound is poised to remain a focal point in innovation. For researchers, staying updated on its synthetic protocols and emerging applications is essential to leverage its full potential.
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