3-Bromo-4-fluorobenzoic acid
3-Bromo-4-fluorobenzoic acid structure
|
Common Name | 3-Bromo-4-fluorobenzoic acid | ||
|---|---|---|---|---|
| CAS Number | 1007-16-5 | Molecular Weight | 219.008 | |
| Density | 1.8±0.1 g/cm3 | Boiling Point | 306.6±27.0 °C at 760 mmHg | |
| Molecular Formula | C7H4BrFO2 | Melting Point | 138-140 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 139.2±23.7 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-Bromo-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 | 1.8±0.1 g/cm3 |
|---|---|
| Boiling Point | 306.6±27.0 °C at 760 mmHg |
| Melting Point | 138-140 °C(lit.) |
| Molecular Formula | C7H4BrFO2 |
| Molecular Weight | 219.008 |
| Flash Point | 139.2±23.7 °C |
| Exact Mass | 217.937866 |
| PSA | 37.30000 |
| LogP | 2.80 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.583 |
| InChIKey | ONELILMJNOWXSA-UHFFFAOYSA-N |
| SMILES | O=C(O)c1ccc(F)c(Br)c1 |
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-S37/39 |
| 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.
|
~99%
3-Bromo-4-fluor... CAS#:1007-16-5 |
| Literature: Ebisawa, Masaru; Ueno, Masahiro; Oshima, Yoshiteru; Kondo, Yoshinori Tetrahedron Letters, 2007 , vol. 48, # 50 p. 8918 - 8921 |
|
~63%
3-Bromo-4-fluor... CAS#:1007-16-5 |
| Literature: Gohier, Frederic; Castanet, Anne-Sophie; Mortier, Jacques Journal of Organic Chemistry, 2005 , vol. 70, # 4 p. 1501 - 1504 |
|
~%
3-Bromo-4-fluor... CAS#:1007-16-5 |
| Literature: Journal of the Indian Chemical Society, , vol. 21, p. 112,114 |
|
~%
3-Bromo-4-fluor... CAS#:1007-16-5 |
| Literature: Journal of the Indian Chemical Society, , vol. 21, p. 112,114 |
|
~%
3-Bromo-4-fluor... CAS#:1007-16-5 |
| Literature: Canadian Journal of Chemistry, , vol. 38, p. 2441 - 2449 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 10 | |
CAS#:369-26-6
CAS#:23233-33-2
CAS#:82702-31-6
CAS#:77771-03-0
CAS#:288309-07-9
CAS#:836619-77-3
CAS#:656-64-4
CAS#:672-75-3
CAS#:1007-15-4
CAS#:1072-85-1This 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.
| 3-Bromo-4-fluorobenzoic acid |
| MFCD00042463 |
| 3-Bromo-4-fluorobenzoicacid |
| EINECS 213-751-6 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 3-Bromo-4-fluorobenzoic Acid have? |
| A: English synonyms of 3-Bromo-4-fluorobenzoic Acid: 3-Bromo-4-fluorobenzoic acid, MFCD00042463, 3-Bromo-4-fluorobenzoicacid, EINECS 213-751-6. |
| Q: What is the CAS number of 3-Bromo-4-fluorobenzoic Acid? |
| A: CAS number of 3-Bromo-4-fluorobenzoic Acid is 1007-16-5. |
| Q: What are the upstream materials of 3-Bromo-4-fluorobenzoic Acid? |
| A: Related upstream materials(CAS) of 3-Bromo-4-fluorobenzoic Acid: 77771-02-9;456-22-4;452-62-0;352-32-9;13194-71-3. |
| Q: What is the melting point of 3-Bromo-4-fluorobenzoic Acid? |
| A: Melting point of 3-Bromo-4-fluorobenzoic Acid is 138-140 °C(lit.). |
| Q: What is the safety information for 3-Bromo-4-fluorobenzoic Acid? |
| A: Safety information for 3-Bromo-4-fluorobenzoic Acid: S26-S37/39. |
| Q: What is the SMILES notation of 3-Bromo-4-fluorobenzoic Acid? |
| A: SMILES notation of 3-Bromo-4-fluorobenzoic Acid is O=C(O)c1ccc(F)c(Br)c1. |
| Q: What is the InChIKey of 3-Bromo-4-fluorobenzoic Acid? |
| A: InChIKey of 3-Bromo-4-fluorobenzoic Acid is ONELILMJNOWXSA-UHFFFAOYSA-N. |
| Q: What are the downstream products of 3-Bromo-4-fluorobenzoic Acid? |
| A: Related downstream products(CAS) of 3-Bromo-4-fluorobenzoic Acid: 369-26-6;23233-33-2;82702-31-6;77771-03-0;288309-07-9;836619-77-3;656-64-4;672-75-3;1007-15-4;1072-85-1. |
| Q: What is the molecular weight of 3-Bromo-4-fluorobenzoic Acid? |
| A: Molecular weight of 3-Bromo-4-fluorobenzoic Acid is 219.008. |
| Q: What is the polar surface area (PSA) of 3-Bromo-4-fluorobenzoic Acid? |
| A: Polar surface area (PSA) of 3-Bromo-4-fluorobenzoic Acid is 37.30000. |
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. |