2-Amino-4-fluorobenzoic acid
2-Amino-4-fluorobenzoic acid structure
|
Common Name | 2-Amino-4-fluorobenzoic acid | ||
|---|---|---|---|---|
| CAS Number | 446-32-2 | Molecular Weight | 155.126 | |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 318.1±27.0 °C at 760 mmHg | |
| Molecular Formula | C7H6FNO2 | Melting Point | 192-196 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 146.2±23.7 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Amino-4-fluorobenzoic 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 | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 318.1±27.0 °C at 760 mmHg |
| Melting Point | 192-196 °C(lit.) |
| Molecular Formula | C7H6FNO2 |
| Molecular Weight | 155.126 |
| Flash Point | 146.2±23.7 °C |
| Exact Mass | 155.038254 |
| PSA | 63.32000 |
| LogP | 1.78 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.606 |
| InChIKey | LGPVTNAJFDUWLF-UHFFFAOYSA-N |
| SMILES | Nc1cc(F)ccc1C(=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-S37/39 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2922499990 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
CAS#:394-01-4
CAS#:2475-81-2
CAS#:60-00-4
CAS#:1006-41-3
CAS#:1863-63-4
CAS#:446-10-6
CAS#:394-27-4
CAS#:367-29-3
CAS#:366-49-4
CAS#:364-78-3
CAS#:557770-90-8
CAS#:345-29-9
CAS#:557770-89-5
CAS#:321-50-6
CAS#:197783-88-3
CAS#:80517-22-2
CAS#:862274-39-3
CAS#:79-37-8
CAS#:59-31-4This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2922499990 |
|---|---|
| Summary | 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% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
Name: Experimentally measured binding affinity data (Ki) for protein-ligand complexes deriv...
Source: Shanghai Institute of Organic Chemistry
Target: N/A
External Id: PDBbind-Ki for protein-ligand complexes
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-fluoro-2-aminobenzoic acid |
| 2-Amino-4-fluorobenzoic |
| 2-Amino-4-fluor-benzoesaeure |
| EINECS 207-163-9 |
| 7-fluoro-2-aminobenzoic acid |
| 4,6-difluoro-2H-indol-2-one |
| 2-Amino-4-FluorobenzoicAcid |
| 4-fluoroanthranlic acid |
| 4-Fluoroanthranilic acid |
| MFCD00075553 |
| 2-Amino-4-fluorobenzoic acid |
| ZR CF FVQ |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 2-Amino-4-fluorobenzoic acid? |
| A: InChIKey of 2-Amino-4-fluorobenzoic acid is LGPVTNAJFDUWLF-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 2-Amino-4-fluorobenzoic acid? |
| A: Related upstream materials(CAS) of 2-Amino-4-fluorobenzoic acid: 394-01-4;2475-81-2;60-00-4;1006-41-3;1863-63-4;446-10-6;394-27-4;367-29-3;366-49-4;364-78-3. |
| Q: What is the CAS number of 2-Amino-4-fluorobenzoic acid? |
| A: CAS number of 2-Amino-4-fluorobenzoic acid is 446-32-2. |
| Q: What is the LogP of 2-Amino-4-fluorobenzoic acid? |
| A: LogP of 2-Amino-4-fluorobenzoic acid is 1.78. |
| Q: What is the SMILES notation of 2-Amino-4-fluorobenzoic acid? |
| A: SMILES notation of 2-Amino-4-fluorobenzoic acid is Nc1cc(F)ccc1C(=O)O. |
| Q: What is the polar surface area (PSA) of 2-Amino-4-fluorobenzoic acid? |
| A: Polar surface area (PSA) of 2-Amino-4-fluorobenzoic acid is 63.32000. |
| Q: What are the downstream products of 2-Amino-4-fluorobenzoic acid? |
| A: Related downstream products(CAS) of 2-Amino-4-fluorobenzoic acid: 394-27-4;557770-90-8;345-29-9;557770-89-5;321-50-6;197783-88-3;80517-22-2;862274-39-3;79-37-8;59-31-4. |
| Q: What English synonyms does 2-Amino-4-fluorobenzoic acid have? |
| A: English synonyms of 2-Amino-4-fluorobenzoic acid: 4-fluoro-2-aminobenzoic acid, 2-Amino-4-fluorobenzoic, 2-Amino-4-fluor-benzoesaeure, EINECS 207-163-9, 7-fluoro-2-aminobenzoic acid, 4,6-difluoro-2H-indol-2-one, 2-Amino-4-FluorobenzoicAcid, 4-fluoroanthranlic acid, 4-Fluoroanthranilic acid, MFCD00075553, 2-Amino-4-fluorobenzoic acid, ZR CF FVQ. |
| Q: What is the melting point of 2-Amino-4-fluorobenzoic acid? |
| A: Melting point of 2-Amino-4-fluorobenzoic acid is 192-196 °C(lit.). |
| Q: What is the English name of 2-Amino-4-fluorobenzoic acid? |
| A: The English name of 2-Amino-4-fluorobenzoic acid is 2-Amino-4-fluorobenzoic acid. |
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. |
| Henan Tianfu Chemical Co., Ltd. |