Cas no 78425-11-3 (3-[(1H-pyrazol-1-yl)methyl]benzaldehyde)
3-[(1H-pyrazol-1-yl)methyl]benzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 3-((1H-Pyrazol-1-yl)methyl)benzaldehyde
- 3-(1H-Pyrazol-1-ylmethyl)benzaldehyde
- 3-(pyrazolylmethyl)benzaldehyde
- AG-H-14733
- CTK5E5775
- MolPort-000-143-720
- SBB090419
- 3-[(1H-pyrazol-1-yl)methyl]benzaldehyde
- DTXSID40594630
- AS-9256
- CS-0313881
- 3-(pyrazol-1-ylmethyl)benzaldehyde
- 3-(1H-Pyrazol-1-ylmethyl)benzaldehyde,97%
- 78425-11-3
- FT-0708037
- AKOS006281428
- SCHEMBL895371
- MFCD08059836
- DB-029176
-
- MDL: MFCD08059836
- Inchi: 1S/C11H10N2O/c14-9-11-4-1-3-10(7-11)8-13-6-2-5-12-13/h1-7,9H,8H2
- InChI Key: VKSSMLBTEXYZDT-UHFFFAOYSA-N
- SMILES: O=CC1=CC=CC(=C1)CN1C=CC=N1
Computed Properties
- Exact Mass: 186.079312947g/mol
- Monoisotopic Mass: 186.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 196
- 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: 1.2
- Topological Polar Surface Area: 34.9?2
Experimental Properties
- Color/Form: No data available
- Density: Not available
- Melting Point: Not available
- Boiling Point: Not available
- Flash Point: Not available
- Refractive Index: 1.592
- PSA: 34.89000
- LogP: 1.74390
- Vapor Pressure: Not available
3-[(1H-pyrazol-1-yl)methyl]benzaldehyde Security Information
- Signal Word:warning
- Hazard Statement: H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
-
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: H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
3-[(1H-pyrazol-1-yl)methyl]benzaldehyde Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM281609-10g |
3-((1H-Pyrazol-1-yl)methyl)benzaldehyde |
78425-11-3 | 95% | 10g |
$446 | 2021-08-18 | |
| Chemenu | CM281609-25g |
3-((1H-Pyrazol-1-yl)methyl)benzaldehyde |
78425-11-3 | 95% | 25g |
$837 | 2021-08-18 | |
| TRC | B530540-500mg |
3-(1H-pyrazol-1-ylmethyl)benzaldehyde |
78425-11-3 | 500mg |
$ 70.00 | 2022-06-07 | ||
| TRC | B530540-1g |
3-(1H-pyrazol-1-ylmethyl)benzaldehyde |
78425-11-3 | 1g |
$ 95.00 | 2022-06-07 | ||
| TRC | B530540-5g |
3-(1H-pyrazol-1-ylmethyl)benzaldehyde |
78425-11-3 | 5g |
$ 340.00 | 2022-06-07 | ||
| Chemenu | CM281609-5g |
3-((1H-Pyrazol-1-yl)methyl)benzaldehyde |
78425-11-3 | 95% | 5g |
$152 | 2024-07-23 | |
| eNovation Chemicals LLC | Y1243874-5g |
3-(1H-PYRAZOL-1-YLMETHYL)BENZALDEHYDE |
78425-11-3 | 95% | 5g |
$315 | 2024-06-07 | |
| Apollo Scientific | OR110014-1g |
3-(1H-Pyrazol-1-ylmethyl)benzaldehyde |
78425-11-3 | 1g |
£170.00 | 2025-02-19 | ||
| abcr | AB216782-1 g |
3-(1H-Pyrazol-1-ylmethyl)benzaldehyde; 95% |
78425-11-3 | 1g |
€128.10 | 2023-01-27 | ||
| abcr | AB216782-5 g |
3-(1H-Pyrazol-1-ylmethyl)benzaldehyde; 95% |
78425-11-3 | 5g |
€301.80 | 2023-01-27 |
3-[(1H-pyrazol-1-yl)methyl]benzaldehyde Related Literature
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
Additional information on 3-[(1H-pyrazol-1-yl)methyl]benzaldehyde
3-[(1H-pyrazol-1-yl)methyl]benzaldehyde: A Comprehensive Overview
3-[(1H-pyrazol-1-yl)methyl]benzaldehyde, also known by its CAS number CAS No. 78425-11-3, is a fascinating organic compound that has garnered significant attention in the fields of chemistry and materials science. This compound is characterized by its unique structure, which combines a benzaldehyde moiety with a pyrazole ring through a methylene group. The pyrazole ring, a five-membered aromatic heterocycle containing two nitrogen atoms, imparts distinctive electronic and steric properties to the molecule, making it highly versatile for various applications.
The synthesis of 3-[(1H-pyrazol-1-yl)methyl]benzaldehyde typically involves multi-step reactions, often starting from readily available starting materials such as benzaldehyde and pyrazole derivatives. One common approach is the nucleophilic substitution reaction, where the pyrazole ring acts as a nucleophile attacking an appropriately substituted benzaldehyde derivative. Recent advancements in catalytic methods have enabled more efficient and selective syntheses, reducing reaction times and improving yields. These developments have made the compound more accessible for both academic research and industrial applications.
3-[(1H-pyrazol-1-yl)methyl]benzaldehyde exhibits remarkable chemical stability under standard conditions, making it suitable for use in various environments. Its electronic properties, particularly the conjugation between the benzene ring and the pyrazole moiety, contribute to its strong absorption in the ultraviolet-visible spectrum. This characteristic has been exploited in the development of novel materials for optoelectronic devices, such as organic light-emitting diodes (OLEDs) and photovoltaic cells.
In recent years, researchers have explored the potential of CAS No. 78425-11-3 in drug discovery. The compound's ability to act as a ligand in metalloenzyme inhibition has shown promise in combating diseases such as cancer and neurodegenerative disorders. For instance, studies have demonstrated that derivatives of this compound can modulate the activity of key enzymes involved in cell signaling pathways, offering new avenues for therapeutic intervention.
The application of 3-[(1H-pyrazol-1-yl)methyl]benzaldehyde extends beyond medicine into materials science. Its use as a precursor in polymer synthesis has led to the development of advanced materials with tailored mechanical and thermal properties. Additionally, its role as an intermediate in organic synthesis has facilitated the construction of complex molecular architectures, further underscoring its importance in modern chemistry.
In conclusion, 3-[(1H-pyrazol-1-yl)methyl]benzaldehyde, or CAS No. 78425-11-3, stands out as a versatile compound with diverse applications across multiple disciplines. Its unique chemical properties, efficient synthesis methods, and promising results in drug discovery and materials science position it as a key player in future innovations. As research continues to uncover new potentials for this compound, its significance in both academic and industrial settings is expected to grow further.
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