Cas no 434-76-4 (2-Amino-6-fluorobenzoic acid)
2-Amino-6-fluorobenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 2-Amino-6-fluorobenzoic acid
- 2-aMino-6-flourobenzoicacid
- 2-Amino-6-Fluorobenzoic
- 2-fluoro-6-aminobenzoic acid
- methyl 2-amino-6-fluoro-5-methylbenzoate
- RARECHEM AL BO 0279
- 6-Fluoroanthranilic acid
- Anthralic acid, 6-fluoro-
- benzoic acid, 2-amino-6-fluoro-
- 6-amino-2-fluorobenzoic acid
- 2-amino-6-fluoro-benzoic acid
- RWSFZKWMVWPDGZ-UHFFFAOYSA-N
- 2-Azanyl-6-Fluoranyl-Benzoic Acid
- 2,amino-6-fluorobenzoic acid
- 4owo
- 6-fluoroanthranilate
- PubChem1324
- 6-Fluoroanthanilic acid
- amino-6-fluorobenzoic acid
- 2-Carboxy-3-fluoroaniline
- Oprea1_302702
- KSC238Q1H
- 2-amino-6-fluoro benzoic acid
- RARECHEM AL B
- 6F0
- F0475
- DTXSID60963006
- AM20061163
- 2-amino-6-luorobenzoic acid
- 2-Amino-6-fluorobenzoicacid
- W-202763
- A1692
- SY005291
- BS-3856
- BP-20086
- Q27456372
- AC-3438
- 2-Amino-6-fluorobenzoic acid, 98%
- InChI=1/C7H6FNO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,9H2,(H,10,11
- 6-FABA
- MFCD00067781
- CHEMBL4453722
- SCHEMBL283962
- CS-W001131
- FT-0621129
- CHEBI:194591
- BCP16598
- HY-W001131
- AKOS005064108
- Z424764636
- EN300-41610
- 434-76-4
- 2-Amino-6-fluorobenzoic acid,98%
- DB-024020
- 6-FABA cpd
-
- MDL: MFCD00067781
- Inchi: 1S/C7H6FNO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,9H2,(H,10,11)
- InChI Key: RWSFZKWMVWPDGZ-UHFFFAOYSA-N
- SMILES: FC1=CC=CC(=C1C(=O)O)N
- BRN: 3540926
Computed Properties
- Exact Mass: 155.03800
- Monoisotopic Mass: 155.038
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 163
- 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: 4
- XLogP3: 1.4
- Topological Polar Surface Area: 63.3
Experimental Properties
- Color/Form: Not available
- Density: 1.3021 (estimate)
- Melting Point: 167-169?°C (lit.)
- Boiling Point: 308.8°C at 760 mmHg
- Flash Point: 140.5℃
- Refractive Index: 1.606
- PSA: 63.32000
- LogP: 1.68730
- Solubility: Not available
2-Amino-6-fluorobenzoic acid 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-S37/39
-
Hazardous Material Identification:
- HazardClass:IRRITANT
- Storage Condition:Keep in dark place,Inert atmosphere,Room temperature
- Risk Phrases:R36/37/38
- Safety Term:S26;S37/39
2-Amino-6-fluorobenzoic 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%
2-Amino-6-fluorobenzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 003980-1g |
2-Amino-6-fluorobenzoic acid |
434-76-4 | 97% | 1g |
£10.00 | 2022-03-01 | |
| Fluorochem | 003980-5g |
2-Amino-6-fluorobenzoic acid |
434-76-4 | 97% | 5g |
£11.00 | 2022-03-01 | |
| Fluorochem | 003980-10g |
2-Amino-6-fluorobenzoic acid |
434-76-4 | 97% | 10g |
£12.00 | 2022-03-01 | |
| Fluorochem | 003980-25g |
2-Amino-6-fluorobenzoic acid |
434-76-4 | 97% | 25g |
£19.00 | 2022-03-01 | |
| Fluorochem | 003980-100g |
2-Amino-6-fluorobenzoic acid |
434-76-4 | 97% | 100g |
£56.00 | 2022-03-01 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | F0475-5G |
2-Amino-6-fluorobenzoic Acid |
434-76-4 | >98.0%(T)(HPLC) | 5g |
¥290.00 | 2024-04-16 | |
| Chemenu | CM158054-500g |
2-Amino-6-fluorobenzoic acid |
434-76-4 | 95+% | 500g |
$318 | 2021-06-17 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | A828736-100g |
2-Amino-6-fluorobenzoic acid |
434-76-4 | 98% | 100g |
¥466.00 | 2022-09-03 | |
| Matrix Scientific | 001696-5g |
2-Amino-6-fluorobenzoic acid, 97% |
434-76-4 | 97% | 5g |
$15.00 | 2023-09-11 | |
| Matrix Scientific | 001696-25g |
2-Amino-6-fluorobenzoic acid, 97% |
434-76-4 | 97% | 25g |
$39.00 | 2023-09-11 |
2-Amino-6-fluorobenzoic acid Production Method
Production Method 1
2-Amino-6-fluorobenzoic acid Raw materials
2-Amino-6-fluorobenzoic acid Preparation Products
2-Amino-6-fluorobenzoic acid Suppliers
2-Amino-6-fluorobenzoic acid Related Literature
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Josué M. Silla,Claudimar J. Duarte,Roberto Rittner,Matheus P. Freitas RSC Adv. 2013 3 25765
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Kovuru Gopalaiah,Anupama Saini,Alka Devi Org. Biomol. Chem. 2017 15 5781
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Kulvadee Dolsophon,Jakapun Soponpong,Jittra Kornsakulkarn,Chawanee Thongpanchang,Samran Prabpai,Palangpon Kongsaeree,Tienthong Thongpanchang Org. Biomol. Chem. 2016 14 11002
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Nianxin Rong,Yongsheng Yuan,Huijie Chen,Changguang Yao,Teng Li,Yantao Wang,Weiran Yang Org. Chem. Front. 2021 8 4479
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Linda Váradi,Michael Breedon,Fiona F. Chen,Adrian Trinchi,Ivan S. Cole,Gang Wei RSC Adv. 2019 9 3994
Additional information on 2-Amino-6-fluorobenzoic acid
Professional Introduction to 2-Amino-6-fluorobenzoic Acid (CAS No. 434-76-4)
2-Amino-6-fluorobenzoic acid, identified by the Chemical Abstracts Service Number (CAS No.) 434-76-4, is a fluorinated benzoic acid derivative that has garnered significant attention in the field of pharmaceutical and chemical research. This compound, characterized by its amino and fluoro substituents, exhibits unique structural and functional properties that make it a valuable intermediate in the synthesis of various biologically active molecules.
The structural motif of 2-amino-6-fluorobenzoic acid incorporates both an amino group (-NH?) and a fluorine atom at the 6-position of the benzoic acid core. This specific arrangement imparts distinct electronic and steric effects, influencing its reactivity and potential biological interactions. The presence of the fluorine atom, in particular, is well-documented to modulate the pharmacokinetic and pharmacodynamic properties of associated molecules, making it a staple in medicinal chemistry.
In recent years, 2-amino-6-fluorobenzoic acid has been extensively studied for its role in the development of novel therapeutic agents. Its derivatives have shown promise in various therapeutic areas, including oncology, anti-inflammatory applications, and antimicrobial treatments. The fluorine atom's ability to enhance metabolic stability and binding affinity has been leveraged to design more effective drug candidates.
One of the most compelling aspects of 2-amino-6-fluorobenzoic acid is its utility as a building block in organic synthesis. Researchers have utilized this compound to construct more complex scaffolds by employing various coupling reactions, such as amide bond formation or palladium-catalyzed cross-coupling reactions. These synthetic strategies have enabled the creation of diverse libraries of compounds for high-throughput screening.
Recent advancements in computational chemistry have further highlighted the significance of 2-amino-6-fluorobenzoic acid. Molecular modeling studies have revealed that its structure can effectively interact with biological targets, such as enzymes and receptors, by optimizing key pharmacophoric elements. This has facilitated the rational design of inhibitors with improved selectivity and potency.
The pharmaceutical industry has also explored the use of 2-amino-6-fluorobenzoic acid in the development of targeted therapies. For instance, its derivatives have been incorporated into small-molecule inhibitors designed to modulate signaling pathways implicated in cancer progression. Preliminary clinical data suggest that compounds derived from this scaffold exhibit encouraging preclinical activity, warranting further investigation.
Beyond its pharmaceutical applications, 2-amino-6-fluorobenzoic acid has found utility in materials science. The unique electronic properties conferred by the fluorine substituent make it a candidate for use in organic electronics, such as light-emitting diodes (LEDs) and photovoltaic cells. Additionally, its ability to form stable complexes with metal ions has been exploited in catalytic systems and coordination chemistry.
The synthesis of 2-amino-6-fluorobenzoic acid itself is an area of active research. While traditional methods involve multi-step processes starting from commercially available precursors, recent innovations have focused on more efficient and sustainable routes. These include biocatalytic approaches that leverage enzymatic transformations to achieve regioselective functionalization.
In conclusion, 2-amino-6-fluorobenzoic acid (CAS No. 434-76-4) represents a versatile and highly valuable compound in modern chemical research. Its unique structural features and broad applicability across multiple disciplines underscore its importance as a chemical entity. As research continues to uncover new possibilities for this compound and its derivatives, its role in advancing scientific discovery is poised to expand even further.
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