(2,3-Difluoro-6-nitrophenyl)acetic acid structure
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Common Name | (2,3-Difluoro-6-nitrophenyl)acetic acid | ||
|---|---|---|---|---|
| CAS Number | 141428-47-9 | Molecular Weight | 217.126 | |
| Density | 1.6±0.1 g/cm3 | Boiling Point | 345.1±37.0 °C at 760 mmHg | |
| Molecular Formula | C8H5F2NO4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 162.5±26.5 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-(2,3-Difluoro-6-nitrophenyl)acetic acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.6±0.1 g/cm3 |
|---|---|
| Boiling Point | 345.1±37.0 °C at 760 mmHg |
| Molecular Formula | C8H5F2NO4 |
| Molecular Weight | 217.126 |
| Flash Point | 162.5±26.5 °C |
| Exact Mass | 217.018661 |
| PSA | 83.12000 |
| LogP | 0.95 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.553 |
| InChIKey | KZNVCGPCWKYPKD-UHFFFAOYSA-N |
| SMILES | O=C(O)Cc1c([N+](=O)[O-])ccc(F)c1F |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
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2,3-Difluoro-6-nitrophenylacetic Acid
SAFETY DATA SHEET Section1. IDENTIFICATION Product name:2,3-Difluoro-6-nitrophenylacetic Acid 5.3 Section2. HAZARDS IDENTIFICATION
GHS classification
PHYSICAL HAZARDSNot classified HEALTH HAZARDS Skin corrosion/irritationCategory 2 Category 2A Serious eye damage/eye irritation ENVIRONMENTAL HAZARDSNot classified GHS label elements, including precautionary statements Pictograms or hazard symbols Signal wordWarning Hazard statementsCauses skin irritation Causes serious eye irritation Precautionary statements: Wash hands thoroughly after handling. [Prevention] Wear protective gloves/eye protection/face protection. IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, [Response] if present and easy to do. Continue rinsing. If eye irritation persists: Get medical advice/attention. IF ON SKIN: Gently wash with plenty of soap and water. If skin irritation occurs: Get medical advice/attention. Take off contaminated clothing and wash before reuse. Section3. COMPOSITION/INFORMATION ON INGREDIENTS Substance/mixture:Substance Components:2,3-Difluoro-6-nitrophenylacetic Acid Percent:>98.0%(GC)(T) CAS Number:141428-47-9 Chemical Formula:C8H5F2NO4 Section4. FIRST AID MEASURES Inhalation:Remove victim to fresh air and keep at rest in a position comfortable for breathing. Get medical advice/attention if you feel unwell. 2,3-Difluoro-6-nitrophenylacetic Acid Section4. FIRST AID MEASURES Skin contact:Remove/Take off immediately all contaminated clothing. Gently wash with plenty of soap and water. If skin irritation or rash occurs: Get medical advice/attention. Eye contact:Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. If eye irritation persists: Get medical advice/attention. Ingestion:Get medical advice/attention if you feel unwell. Rinse mouth. A rescuer should wear personal protective equipment, such as rubber gloves and air- Protection of first-aiders: tight goggles. Section5. FIRE-FIGHTING MEASURES Suitable extinguishingDry chemical, foam, water spray, carbon dioxide. media: Specific hazards arising Take care as it may decompose upon combustion or in high temperatures to from the chemical:generate poisonous fume. Precautions for firefighters: Fire-extinguishing work is done from the windward and the suitable fire-extinguishing method according to the surrounding situation is used. Uninvolved persons should evacuate to a safe place. In case of fire in the surroundings: Remove movable containers if safe to do so. Special protectiveWhen extinguishing fire, be sure to wear personal protective equipment. equipment for firefighters: Section6. ACCIDENTAL RELEASE MEASURES Personal precautions,Use personal protective equipment. Keep people away from and upwind of spill/leak. protective equipment and Entry to non-involved personnel should be controlled around the leakage area by emergency procedures: roping off, etc. Environmental precautions: Prevent product from entering drains. Methods and materials for Sweep dust to collect it into an airtight container, taking care not to disperse it. containment and cleaning Adhered or collected material should be promptly disposed of, in accordance with up: appropriate laws and regulations. Section7. HANDLING AND STORAGE Precautions for safe handling Technical measures:Handling is performed in a well ventilated place. Wear suitable protective equipment. Prevent dispersion of dust. Wash hands and face thoroughly after handling. Use a local exhaust if dust or aerosol will be generated. Advice on safe handling: Avoid contact with skin, eyes and clothing. Conditions for safe storage, including any incompatibilities Storage conditions:Keep container tightly closed. Store in a cool and dark place. Store away from incompatible materials such as oxidizing agents. Packaging material:Comply with laws. Section8. EXPOSURE CONTROLS / PERSONAL PROTECTION Engineering controls:Install a closed system or local exhaust as possible so that workers should not be exposed directly. Also install safety shower and eye bath. Personal protective equipment Respiratory protection: Dust respirator. Follow local and national regulations. Hand protection:Protective gloves. Safety glasses. A face-shield, if the situation requires. Eye protection: Skin and body protection: Protective clothing. Protective boots, if the situation requires. Section9. PHYSICAL AND CHEMICAL PROPERTIES Physical state (20°C):Solid Crystal- Powder Form: Colour:Slightly pale yellow - Yellow No data available Odour: 2,3-Difluoro-6-nitrophenylacetic Acid Section9. PHYSICAL AND CHEMICAL PROPERTIES pH: No data available Melting point/freezing point:156°C Boiling point/range:No data available Flash point:No data available Flammability or explosive limits: Lower:No data available Upper:No data available Relative density:No data available Solubility(ies): [Water]No data available [Other solvents] Slightly soluble:Methanol Section10. STABILITY AND REACTIVITY Chemical stability:Stable under proper conditions. Possibility of hazardous No special reactivity has been reported. reactions: Incompatible materials: Oxidizing agents Hazardous decomposition Carbon monoxide, Carbon dioxide, Nitrogen oxides (NOx), Hydrogen fluoride products: Section11. TOXICOLOGICAL INFORMATION Acute Toxicity:No data available Skin corrosion/irritation: No data available Serious eyeNo data available damage/irritation: Germ cell mutagenicity: No data available Carcinogenicity: IARC =No data available NTP =No data available Reproductive toxicity:No data available Section12. ECOLOGICAL INFORMATION Ecotoxicity: Fish:No data available Crustacea:No data available No data available Algae: Persistence / degradability: No data available No data available Bioaccumulative potential(BCF): Mobility in soil Log Pow:No data available Soil adsorption (Koc):No data available Henry's LawNo data available constant(PaM3/mol): Section13. DISPOSAL CONSIDERATIONS Recycle to process, if possible. Consult your local regional authorities. You may be able to dissolve or mix material with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system. Observe all federal, state and local regulations when disposing of the substance. Section14. TRANSPORT INFORMATION Hazards Class:Does not correspond to the classification standard of the United Nations UN-No:Not listed 2,3-Difluoro-6-nitrophenylacetic Acid Section15. REGULATORY INFORMATION Safe management ordinance of dangerous chemical product (State Council announces on January 26, 2002 and revised on February 16,2011): Safe use and production, the storage of a dangerous chemical, transport, loading and unloading were prescribed. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2916399090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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(2,3-Difluoro-6... CAS#:141428-47-9
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| Literature: US2006/30609 A1, ; Page/Page column 17 ; |
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(2,3-Difluoro-6... CAS#:141428-47-9
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| Literature: WO2007/36715 A2, ; Page/Page column 48 ; WO 2007/036715 A2 |
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~59%
(2,3-Difluoro-6... CAS#:141428-47-9 |
| Literature: Lee, Lily; Kreutter, Kevin D.; Pan, Wenxi; Crysler, Carl; Spurlino, John; Player, Mark R.; Tomczuk, Bruce; Lu, Tianbao Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 22 p. 6266 - 6269 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 2 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (2,3-Difluoro-6-nitrophenyl)acetic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: The English name of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid is 2-(2,3-Difluoro-6-nitrophenyl)acetic acid. |
| Q: What English synonyms does 2-(2,3-Difluoro-6-nitrophenyl)acetic acid have? |
| A: English synonyms of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid: (2,3-Difluoro-6-nitrophenyl)acetic acid. |
| Q: What is the molecular weight of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: Molecular weight of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid is 217.126. |
| Q: What are the upstream materials of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: Related upstream materials(CAS) of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid: 145689-41-4;996-82-7;771-69-7. |
| Q: What are the downstream products of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: Related downstream products(CAS) of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid: 932373-72-3;914348-35-9. |
| Q: What is the molecular formula of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: Molecular formula of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid is C8H5F2NO4. |
| Q: What is the SMILES notation of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: SMILES notation of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid is O=C(O)Cc1c([N+](=O)[O-])ccc(F)c1F. |
| Q: What is the InChIKey of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: InChIKey of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid is KZNVCGPCWKYPKD-UHFFFAOYSA-N. |
| Q: What is the CAS number of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: CAS number of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid is 141428-47-9. |
| Q: What is the polar surface area (PSA) of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid? |
| A: Polar surface area (PSA) of 2-(2,3-Difluoro-6-nitrophenyl)acetic acid is 83.12000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |