5-Fluoro-2-nitrobenzoic acid
5-Fluoro-2-nitrobenzoic acid structure
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Common Name | 5-Fluoro-2-nitrobenzoic acid | ||
|---|---|---|---|---|
| CAS Number | 320-98-9 | Molecular Weight | 185.109 | |
| Density | 1.6±0.1 g/cm3 | Boiling Point | 344.2±27.0 °C at 760 mmHg | |
| Molecular Formula | C7H4FNO4 | Melting Point | 131-134 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 162.0±23.7 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-Fluoro-2-nitrobenzoic 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 | 344.2±27.0 °C at 760 mmHg |
| Melting Point | 131-134 °C(lit.) |
| Molecular Formula | C7H4FNO4 |
| Molecular Weight | 185.109 |
| Flash Point | 162.0±23.7 °C |
| Exact Mass | 185.012436 |
| PSA | 83.12000 |
| LogP | 1.63 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.588 |
| InChIKey | GHYZIXDKAPMFCS-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cc(F)ccc1[N+](=O)[O-] |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36-S36/37/39-S22 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2916399090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~98%
5-Fluoro-2-nitr... CAS#:320-98-9 |
| Literature: The Rockefeller University; Alteon Inc. Patent: US5514676 A1, 1996 ; |
|
~31%
5-Fluoro-2-nitr... CAS#:320-98-9 |
| Literature: Takeda Chemical Industries, Inc. Patent: US6407116 B1, 2002 ; |
|
~%
5-Fluoro-2-nitr... CAS#:320-98-9 |
| Literature: US2006/14807 A1, ; Page/Page column sheet 2; 44-45 ; US 20060014807 A1 |
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~%
5-Fluoro-2-nitr... CAS#:320-98-9 |
| Literature: Recueil des Travaux Chimiques des Pays-Bas, , vol. 33, p. 336 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 10 | |
CAS#:319-24-4
CAS#:393-85-1
CAS#:395-81-3
CAS#:446-08-2
CAS#:287121-32-8
CAS#:603306-52-1
CAS#:63069-49-8
CAS#:364-51-2
CAS#:3416-05-5
CAS#:13280-60-9This 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 lists relevant public references with title, journal and publication metadata for this compound.
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The discovery of N-cyclopropyl-4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxoquinazolin-3(4H)-yl]benzamide (AZD6703), a clinical p38α MAP kinase inhibitor for the treatment of inflammatory diseases
Bioorg. Med. Chem. Lett. 22(12) , 3879-83, (2012) A novel, potent and selective quinazolinone series of inhibitors of p38α MAP kinase has been identified. Modifications designed to address the issues of poor aqueous solubility and high plasma protein... |
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Solution and solid-phase approaches to quinconazole and fluquinconazole-inhibitors of fungal ergosterol biosynthesis. Bilokin YV and Kovalenko SM.
Heterocycl. Comm. 6(5) , 409-414, (2000)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-fluoro-2-nitro-benzoic acid |
| 5-fluoro-2-nitorobenzoic acid |
| 5-Fluor-2-nitro-benzoesaeure |
| 2-Carboxy-4-fluoronitrobenzene |
| 5-Fluoro-2-nitrobenzoic acid |
| 2-Nitro-5-fluorobenzoic acid |
| 3-fluoro-6-nitrobenzoic acid |
| BENZOIC ACID,5-FLUORO-2-NITRO |
| MFCD00055635 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 5-Fluoro-2-nitrobenzoic acid? |
| A: CAS number of 5-Fluoro-2-nitrobenzoic acid is 320-98-9. |
| Q: What is the InChIKey of 5-Fluoro-2-nitrobenzoic acid? |
| A: InChIKey of 5-Fluoro-2-nitrobenzoic acid is GHYZIXDKAPMFCS-UHFFFAOYSA-N. |
| Q: What is the English name of 5-Fluoro-2-nitrobenzoic acid? |
| A: The English name of 5-Fluoro-2-nitrobenzoic acid is 5-Fluoro-2-nitrobenzoic acid. |
| Q: What are the downstream products of 5-Fluoro-2-nitrobenzoic acid? |
| A: Related downstream products(CAS) of 5-Fluoro-2-nitrobenzoic acid: 319-24-4;393-85-1;395-81-3;446-08-2;287121-32-8;603306-52-1;63069-49-8;364-51-2;3416-05-5;13280-60-9. |
| Q: What English synonyms does 5-Fluoro-2-nitrobenzoic acid have? |
| A: English synonyms of 5-Fluoro-2-nitrobenzoic acid: 5-fluoro-2-nitro-benzoic acid, 5-fluoro-2-nitorobenzoic acid, 5-Fluor-2-nitro-benzoesaeure, 2-Carboxy-4-fluoronitrobenzene, 5-Fluoro-2-nitrobenzoic acid, 2-Nitro-5-fluorobenzoic acid, 3-fluoro-6-nitrobenzoic acid, BENZOIC ACID,5-FLUORO-2-NITRO, MFCD00055635. |
| Q: What is the molecular weight of 5-Fluoro-2-nitrobenzoic acid? |
| A: Molecular weight of 5-Fluoro-2-nitrobenzoic acid is 185.109. |
| Q: What is the molecular formula of 5-Fluoro-2-nitrobenzoic acid? |
| A: Molecular formula of 5-Fluoro-2-nitrobenzoic acid is C7H4FNO4. |
| Q: What is the safety information for 5-Fluoro-2-nitrobenzoic acid? |
| A: Safety information for 5-Fluoro-2-nitrobenzoic acid: S26-S36-S36/37/39-S22. |
| Q: What is the SMILES notation of 5-Fluoro-2-nitrobenzoic acid? |
| A: SMILES notation of 5-Fluoro-2-nitrobenzoic acid is O=C(O)c1cc(F)ccc1[N+](=O)[O-]. |
| Q: What is the LogP of 5-Fluoro-2-nitrobenzoic acid? |
| A: LogP of 5-Fluoro-2-nitrobenzoic acid is 1.63. |
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. |