2-(Trifluoromethoxy)benzoic acid
2-(Trifluoromethoxy)benzoic acid structure
|
Common Name | 2-(Trifluoromethoxy)benzoic acid | ||
|---|---|---|---|---|
| CAS Number | 1979-29-9 | Molecular Weight | 206.119 | |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 231.6±35.0 °C at 760 mmHg | |
| Molecular Formula | C8H5F3O3 | Melting Point | 78 °C | |
| MSDS | Chinese USA | Flash Point | 93.9±25.9 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Summary: 2-(Trifluoromethoxy)benzoic acid, also known as 2-(trifluoromethoxy)benzoic acid, has a molecular formula of C8H5F3O3 and a molecular weight of 206.119. Its CAS number is 1979-29-9, with a melting point of 78°C and a boiling point of 231.6±35.0°C. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-(Trifluoromethoxy)benzoic 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 | 231.6±35.0 °C at 760 mmHg |
| Melting Point | 78 °C |
| Molecular Formula | C8H5F3O3 |
| Molecular Weight | 206.119 |
| Flash Point | 93.9±25.9 °C |
| Exact Mass | 206.019073 |
| PSA | 46.53000 |
| LogP | 2.53 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.478 |
| InChIKey | JMYSPFGUBNENSE-UHFFFAOYSA-N |
| SMILES | O=C(O)c1ccccc1OC(F)(F)F |
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 | H302-H319 |
| Precautionary Statements | P305 + P351 + P338 |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36/37/39-S37/39 |
| RIDADR | NONH for all modes of transport |
| HS Code | 2918990090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~77%
2-(Trifluoromet... CAS#:1979-29-9 |
| Literature: European Journal of Organic Chemistry, , # 4 p. 691 - 695 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 2 | |
CAS#:162046-61-9
CAS#:175278-07-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2918990090 |
|---|---|
| Summary | 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| RARECHEM AL BO 0449 |
| o-trifluoromethoxybenzoic acid |
| 2-TtrifluoroMethoxybenzoicacid |
| α,α,α-Trifluoro-o-anisic acid |
| 2-Trifluormethoxy-benzoesaeure |
| QVR BOXFFF |
| o-(Trifluoromethoxy)benzoic acid |
| 2-trifluoromethoxybenzoic acid |
| 2-(Trifluoromethoxy)benzoic acid |
| MFCD00052325 |
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-(Trifluoromethoxy)benzoic acid? |
| A: The English name of 2-(Trifluoromethoxy)benzoic acid is 2-(Trifluoromethoxy)benzoic acid. |
| Q: What is the melting point of 2-(Trifluoromethoxy)benzoic acid? |
| A: Melting point of 2-(Trifluoromethoxy)benzoic acid is 78 °C. |
| Q: What is the safety information for 2-(Trifluoromethoxy)benzoic acid? |
| A: Safety information for 2-(Trifluoromethoxy)benzoic acid: S26-S36/37/39-S37/39. |
| Q: What is the molecular formula of 2-(Trifluoromethoxy)benzoic acid? |
| A: Molecular formula of 2-(Trifluoromethoxy)benzoic acid is C8H5F3O3. |
| Q: What is the boiling point of 2-(Trifluoromethoxy)benzoic acid? |
| A: Boiling point of 2-(Trifluoromethoxy)benzoic acid is 231.6±35.0 °C at 760 mmHg. |
| Q: What are the downstream products of 2-(Trifluoromethoxy)benzoic acid? |
| A: Related downstream products(CAS) of 2-(Trifluoromethoxy)benzoic acid: 162046-61-9;175278-07-6. |
| Q: What is the InChIKey of 2-(Trifluoromethoxy)benzoic acid? |
| A: InChIKey of 2-(Trifluoromethoxy)benzoic acid is JMYSPFGUBNENSE-UHFFFAOYSA-N. |
| Q: What English synonyms does 2-(Trifluoromethoxy)benzoic acid have? |
| A: English synonyms of 2-(Trifluoromethoxy)benzoic acid: RARECHEM AL BO 0449, o-trifluoromethoxybenzoic acid, 2-TtrifluoroMethoxybenzoicacid, α,α,α-Trifluoro-o-anisic acid, 2-Trifluormethoxy-benzoesaeure, QVR BOXFFF, o-(Trifluoromethoxy)benzoic acid, 2-trifluoromethoxybenzoic acid, 2-(Trifluoromethoxy)benzoic acid, MFCD00052325. |
| Q: What is the CAS number of 2-(Trifluoromethoxy)benzoic acid? |
| A: CAS number of 2-(Trifluoromethoxy)benzoic acid is 1979-29-9. |
| Q: What is the SMILES notation of 2-(Trifluoromethoxy)benzoic acid? |
| A: SMILES notation of 2-(Trifluoromethoxy)benzoic acid is O=C(O)c1ccccc1OC(F)(F)F. |
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. |