Cas no 125483-00-3 (3-Amino-4-(trifluoromethyl)benzoic acid)
3-Amino-4-(trifluoromethyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-Amino-4-(trifluoromethyl)benzoic acid
- Benzoic acid,3-amino-4-(trifluoromethyl)-
- 3-Amino-4-trifluoromethylbenzoic acid
- ALLYLALPHA-D-GALACTOPYRANOSIDE
- Benzoic acid, 3-amino-4-(trifluoromethyl)- (9CI)
- 5-Carboxy-2-(trifluoromethyl)aniline, 2-Amino-4-carboxybenzotrifluoride
- 3-Amino-4-trifluoromethyl-benzoic acid
- FT-0649398
- SB77582
- SY031461
- AC-3895
- CL8064
- InChI=1/C8H6F3NO2/c9-8(10,11)5-2-1-4(7(13)14)3-6(5)12/h1-3H,12H2,(H,13,14
- 3-Amino-4-(trifluoromethyl)benzoic acid, AldrichCPR
- J-511598
- SCHEMBL403027
- BB 0261331
- 125483-00-3
- AKOS015854611
- 2-amino-alpha,alpha,alpha-trifluoro-p-toluic acid
- EN300-102228
- 4857-33-4
- 3-Amino-4-(trifluoromethyl)benzoicacid
- TS-02914
- benzoic acid, 3-amino-4-(trifluoromethyl)-
- CS-W018904
- A905302
- AM82971
- MFCD07784307
- A19957
- FT-0645772
- SB34884
- 3-Amino-4-(trifluoromethyl)benzoicacid98%
- 3-Amino-4-(trifluoromethyl)benzoic acid 98%
- DB-015988
-
- MDL: MFCD07784307
- Inchi: 1S/C8H6F3NO2/c9-8(10,11)5-2-1-4(7(13)14)3-6(5)12/h1-3H,12H2,(H,13,14)
- InChI Key: RVYKHFGOJJKVNB-UHFFFAOYSA-N
- SMILES: FC(C1C=CC(C(=O)O)=CC=1N)(F)F
Computed Properties
- Exact Mass: 205.03500
- Monoisotopic Mass: 205.03506292g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- 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
- XLogP3: 1.7
- Topological Polar Surface Area: 63.3?2
Experimental Properties
- Density: 1.489
- Melting Point: 203-205°C
- Boiling Point: 325.4℃ at 760 mmHg
- PSA: 63.32000
- LogP: 2.56700
3-Amino-4-(trifluoromethyl)benzoic acid Customs Data
- HS CODE:2922499990
- Customs Data:
China Customs Code:
2922499990Overview:
2922499990 Other amino acids and their esters and their salts(Except those containing more than one oxygen-containing group). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods) MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared
Regulatory conditions:
A.Customs clearance form for Inbound Goods
B.Customs clearance form for outbound goodsInspection and quarantine category:
P.Imported animals and plants\Quarantine of animal and plant products
Q.Outbound animals and plants\Quarantine of animal and plant products
R.Sanitary supervision and inspection of imported food
S.Sanitary supervision and inspection of exported food
M.Import commodity inspection
N.Export commodity inspectionSummary:
HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%
3-Amino-4-(trifluoromethyl)benzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | A190317-1g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 98% | 1g |
¥155.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | A190317-250mg |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 98% | 250mg |
¥54.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | A190317-25g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 98% | 25g |
¥2104.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | A190317-5g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 98% | 5g |
¥585.90 | 2023-09-04 | |
| Fluorochem | 065701-1g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 97% | 1g |
£24.00 | 2022-03-01 | |
| Fluorochem | 065701-5g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 97% | 5g |
£64.00 | 2022-03-01 | |
| Fluorochem | 065701-10g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 97% | 10g |
£108.00 | 2022-03-01 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 021433-1g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 98% | 1g |
437.0CNY | 2021-07-06 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 021433-5g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 98% | 5g |
1477.0CNY | 2021-07-06 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 021433-25g |
3-Amino-4-(trifluoromethyl)benzoic acid |
125483-00-3 | 98% | 25g |
4388.0CNY | 2021-07-06 |
3-Amino-4-(trifluoromethyl)benzoic acid Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
Additional information on 3-Amino-4-(trifluoromethyl)benzoic acid
Recent Advances in the Application of 3-Amino-4-(trifluoromethyl)benzoic acid (CAS: 125483-00-3) in Chemical Biology and Pharmaceutical Research
3-Amino-4-(trifluoromethyl)benzoic acid (CAS: 125483-00-3) is a fluorinated aromatic compound that has garnered significant attention in recent years due to its versatile applications in medicinal chemistry and drug discovery. The trifluoromethyl group (-CF3) and amino (-NH2) functional groups confer unique physicochemical properties, making this compound a valuable building block for the synthesis of bioactive molecules. This research briefing highlights the latest advancements in the utilization of 3-Amino-4-(trifluoromethyl)benzoic acid, focusing on its role in the development of novel therapeutics and chemical probes.
Recent studies have demonstrated the potential of 3-Amino-4-(trifluoromethyl)benzoic acid as a key intermediate in the synthesis of small-molecule inhibitors targeting various disease-associated proteins. For instance, a 2023 study published in the Journal of Medicinal Chemistry reported the use of this compound in the development of potent inhibitors for protein kinases involved in cancer progression. The researchers employed structure-activity relationship (SAR) studies to optimize the compound's binding affinity and selectivity, resulting in lead candidates with promising in vitro and in vivo efficacy.
In addition to its role in drug discovery, 3-Amino-4-(trifluoromethyl)benzoic acid has been explored as a versatile scaffold for the design of chemical probes in chemical biology. A recent publication in ACS Chemical Biology detailed the synthesis of fluorescent derivatives of this compound, which were used to visualize and track specific cellular processes. The trifluoromethyl group was found to enhance the probes' stability and membrane permeability, making them particularly useful for live-cell imaging applications.
The compound's unique electronic properties, attributed to the electron-withdrawing nature of the -CF3 group, have also been leveraged in materials science. A 2022 study in Advanced Materials demonstrated the incorporation of 3-Amino-4-(trifluoromethyl)benzoic acid into polymeric materials, resulting in enhanced thermal stability and optical properties. These findings open new avenues for the application of this compound in the development of advanced materials for biomedical devices and sensors.
Despite its promising applications, challenges remain in the large-scale synthesis and purification of 3-Amino-4-(trifluoromethyl)benzoic acid. Recent advancements in synthetic methodologies, including flow chemistry and catalytic fluorination, have addressed some of these issues, as reported in a 2023 Organic Process Research & Development article. These innovations have improved the yield and scalability of the compound, facilitating its broader adoption in industrial and academic research settings.
In conclusion, 3-Amino-4-(trifluoromethyl)benzoic acid (CAS: 125483-00-3) continues to be a compound of significant interest in chemical biology and pharmaceutical research. Its unique structural features and versatile applications make it a valuable tool for drug discovery, chemical probe development, and materials science. Ongoing research efforts are expected to further expand its utility and address current limitations in synthesis and application.
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