Cas no 447-61-0 (2-(Trifluoromethyl)benzaldehyde)
2-(Trifluoromethyl)benzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 2-(Trifluoromethyl)benzaldehyde
- 2-Trifluoromethylbenzaldehyde
- ALPHA,ALPHA,ALPHA-TRIFLUORO-O-TOLUALDEHYDE
- 2-(Trifluoromthyl)benzaldehyde
- 2-Formylbenzotrifluoride
- 2-Trifluormethylbenzaldehyde
- A,A,A-TRIFLUORO-O-TOLUALDEHYDE
- BENZOTRIFLUORIDE-2-CARBALDEHYDE
- o-benzaldehyde
- OTF-BAD
- o-trifluoromethyl-benzaldehyde
- trifluoromethylbenzaldehyde
- α,α,α-Trifluoro-o-tolualdehyde
- o-(Trifluoromethyl)benzaldehyde
- o-trifluoromethylbenzaldehyde
- Benzaldehyde, 2-(trifluoromethyl)-
- 2-(trifluoromethyl)-benzaldehyde
- ortho-trifluoromethyl-benzaldehyde
- o-trifluoromethyl benzaldehyde
- o-Tolualdehyde, .alpha.,.alpha.,.alpha.-trifluoro-
- 2-(Trifluoromethyl)benzalde
- 2-(Trifluoromethyl)benzaldehyde,98%
- Z104476826
- CS-W009016
- FT-0608952
- 447-61-0
- SY003300
- AKOS000119868
- 2-trifluoromethyibenzaldehyde
- WQVKQXWKOXNFEH-UHFFFAOYSA-N
- .alpha.,.alpha.,.alpha.-Trifluoro-o-tolualdehyde
- NS00005334
- F2191-0140
- PS-8633
- 2-trifluoromethyl-benzaldehyde
- MFCD00003337
- EN300-20098
- DTXSID40196279
- EC 207-185-9
- BDBM93344
- 2-(Trifluoromethyl)benzaldehyde, 98%
- 2-Trifluoromethyl benzaldehyde
- ortho(trifluoromethyl)benzaldehyde
- ortho-(trifluoromethyl)benzaldehyde
- CHEMBL4549081
- AM20060045
- SCHEMBL67207
- 2-(trifluoromethyl) -benzaldehyde
- W-106176
- EINECS 207-185-9
- AC-2901
- Integrase inhibitor, R2{5}
- A7105
- T1281
- InChI=1/C8H5F3O/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-5
- A826680
- alpha,alpha,alpha-Trifluoro-o-tolualdehyde;2-trifluoromethylbenzaldehyde
- DB-024048
-
- MDL: MFCD00003337
- Inchi: 1S/C8H5F3O/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-5H
- InChI Key: ZDVRPKUWYQVVDX-UHFFFAOYSA-N
- SMILES: FC(C1C=CC=CC=1C=O)(F)F
- BRN: 2045512
Computed Properties
- Exact Mass: 174.02900
- Monoisotopic Mass: 174.029
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 164
- 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: 2.6
- Topological Polar Surface Area: 17.1
Experimental Properties
- Color/Form: Not determined
- Density: 1.32?g/mL?at 25?°C(lit.)
- Melting Point: -40 oC
- Boiling Point: 70°C/15.8mmHg
- Flash Point: Fahrenheit: 141.8 ° f
Celsius: 61 ° c - Refractive Index: n20/D 1.466(lit.)
- Solubility: Soluble in most organic solvents.
- PSA: 17.07000
- LogP: 2.51790
- Sensitiveness: Air Sensitive
- Solubility: Not determined
2-(Trifluoromethyl)benzaldehyde Security Information
-
Symbol:
- Prompt:warning
- Signal Word:Warning
- Hazard Statement: H315,H319,H335
- Warning Statement: P261,P305+P351+P338
- Hazardous Material transportation number:NONH for all modes of transport
- WGK Germany:3
- Hazard Category Code: 36/37/38
- Safety Instruction: S26-S36/37/39-S37/39
-
Hazardous Material Identification:
- HazardClass:3
- PackingGroup:III
- Storage Condition:Store at room temperature
- Risk Phrases:R36/37/38
- Safety Term:S26;S37/39
2-(Trifluoromethyl)benzaldehyde Customs Data
- HS CODE:2912299000
- Customs Data:
China Customs Code:
2913000090Overview:
2913000090 Item2912Other derivatives of the listed products [refer to halogenation,sulfonation,Nitrosative or nitrosative derivatives]. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%
2-(Trifluoromethyl)benzaldehyde Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 007580-25g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 25g |
£14.00 | 2022-03-01 | |
| Fluorochem | 007580-100g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 100g |
£44.00 | 2022-03-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | T102705-100g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 100g |
¥125.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | T102705-25g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 25g |
¥84.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | T102705-500g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 500g |
¥515.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | T102705-5g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 5g |
¥29.90 | 2023-09-01 | |
| Chemenu | CM252999-500g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 95+% | 500g |
$184 | 2021-06-16 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R002739-100g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 100g |
¥150 | 2024-05-23 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R002739-25g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 25g |
¥40 | 2024-05-23 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R002739-5g |
2-(Trifluoromethyl)benzaldehyde |
447-61-0 | 98% | 5g |
¥29 | 2024-05-23 |
2-(Trifluoromethyl)benzaldehyde Suppliers
2-(Trifluoromethyl)benzaldehyde Related Literature
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Hai Anh Le Phuong,Levente Cseri,George F. S. Whitehead,Arthur Garforth,Peter Budd,Gyorgy Szekely RSC Adv. 2017 7 53278
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Yuan Jay Chang,Tahsin J. Chow J. Mater. Chem. 2011 21 9523
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Qian Yang,Xin Cheng,YeXin Wang,BingWu Wang,ZheMing Wang,Song Gao Dalton Trans. 2015 44 8938
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4. (l)-Prolinamide imidazolium hexafluorophosphate ionic liquid as an efficient reusable organocatalyst for direct asymmetric aldol reaction in solvent-free conditionGeeta Devi Yadav,Surendra Singh RSC Adv. 2016 6 100459
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Tao Deng,Chun Cai RSC Adv. 2014 4 27853
Additional information on 2-(Trifluoromethyl)benzaldehyde
Exploring the Versatile Applications and Properties of 2-(Trifluoromethyl)benzaldehyde (CAS No. 447-61-0)
2-(Trifluoromethyl)benzaldehyde (CAS No. 447-61-0) is a highly versatile fluorinated aromatic aldehyde that has garnered significant attention in recent years due to its unique chemical properties and wide-ranging applications. As a trifluoromethyl-substituted benzaldehyde, this compound plays a crucial role in pharmaceutical synthesis, agrochemical development, and advanced material science. The presence of the electron-withdrawing trifluoromethyl group at the ortho position significantly influences the compound's reactivity, making it particularly valuable for various synthetic transformations.
The growing demand for fluorinated organic compounds in modern chemistry has positioned 2-(Trifluoromethyl)benzaldehyde as a key building block in numerous industrial processes. Researchers and manufacturers frequently search for information about "2-(Trifluoromethyl)benzaldehyde synthesis", "CAS 447-61-0 applications", and "trifluoromethyl benzaldehyde derivatives", reflecting the compound's importance in contemporary chemical research. Its molecular structure, featuring both an aldehyde functional group and a trifluoromethyl substituent, enables diverse chemical modifications that are essential for creating specialized materials and bioactive molecules.
In the pharmaceutical sector, 2-(Trifluoromethyl)benzaldehyde serves as a critical intermediate for the production of various drug candidates. The trifluoromethyl group is known to enhance metabolic stability and bioavailability, making it a sought-after moiety in medicinal chemistry. Recent studies have explored its use in developing novel anti-inflammatory agents and central nervous system (CNS) drugs, addressing current healthcare challenges. The compound's ability to participate in condensation reactions, nucleophilic additions, and other transformations makes it invaluable for constructing complex molecular architectures.
The material science field has also benefited from the unique properties of 2-(Trifluoromethyl)benzaldehyde. Researchers investigating "fluorinated liquid crystals" and "high-performance polymers" often utilize this compound as a starting material. The trifluoromethyl group imparts desirable characteristics such as enhanced thermal stability, chemical resistance, and optical properties to the resulting materials. These attributes are particularly valuable in applications ranging from electronic displays to specialty coatings, meeting the growing demand for advanced functional materials in various industries.
From a synthetic chemistry perspective, 2-(Trifluoromethyl)benzaldehyde offers numerous possibilities for creating diverse molecular structures. The compound readily participates in Knoevenagel condensations, Wittig reactions, and reductive aminations, making it a versatile tool for organic synthesis. Recent publications have highlighted its use in developing novel heterocyclic compounds with potential biological activities, addressing current research trends in drug discovery and agrochemical development.
The market for 2-(Trifluoromethyl)benzaldehyde has shown steady growth, driven by increasing demand from pharmaceutical and specialty chemical industries. Manufacturers and suppliers frequently update their product listings with information about "CAS 447-61-0 purity", "2-(Trifluoromethyl)benzaldehyde suppliers", and "bulk quantities of fluorinated aldehydes". Quality control measures typically include rigorous testing for parameters such as purity (often ≥98%), water content, and residual solvents to ensure the compound meets the exacting standards of research and industrial applications.
Environmental considerations and green chemistry principles have influenced recent developments in the production and application of 2-(Trifluoromethyl)benzaldehyde. Researchers are exploring more sustainable synthetic routes and investigating the compound's environmental fate, responding to growing concerns about green chemistry and sustainable chemical processes. These efforts align with broader industry trends toward eco-friendly manufacturing and responsible chemical management.
Analytical characterization of 2-(Trifluoromethyl)benzaldehyde typically involves techniques such as gas chromatography (GC), high-performance liquid chromatography (HPLC), nuclear magnetic resonance (NMR) spectroscopy, and mass spectrometry (MS). These methods provide comprehensive information about the compound's purity and structural features, essential for quality assurance in both research and industrial settings. The distinct spectral signatures of the trifluoromethyl group and aldehyde proton serve as valuable diagnostic features in structural verification.
Handling and storage recommendations for 2-(Trifluoromethyl)benzaldehyde emphasize proper containment in tightly sealed containers under inert atmosphere when necessary. While not classified as hazardous under standard conditions, appropriate laboratory practices should be followed to maintain compound integrity and ensure safe usage. These precautions are particularly important for researchers searching for "2-(Trifluoromethyl)benzaldehyde safety data" or "CAS 447-61-0 handling guidelines".
The future outlook for 2-(Trifluoromethyl)benzaldehyde appears promising, with ongoing research exploring new applications in catalysis, material science, and medicinal chemistry. As the chemical industry continues to recognize the value of fluorinated compounds, the demand for specialized intermediates like 2-(Trifluoromethyl)benzaldehyde is expected to grow. This trend is reflected in increasing patent activity and scientific publications focusing on novel uses of this versatile compound.
For researchers and industry professionals seeking detailed technical information about 2-(Trifluoromethyl)benzaldehyde, numerous resources are available through scientific literature, chemical databases, and specialized suppliers. The compound's unique combination of reactivity and stability ensures its continued importance in advancing chemical innovation across multiple disciplines. As synthetic methodologies evolve and new applications emerge, 2-(Trifluoromethyl)benzaldehyde will likely maintain its position as a valuable tool in modern chemistry.
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