3-Trifluoromethylbutyric acid
3-Trifluoromethylbutyric acid structure
|
Common Name | 3-Trifluoromethylbutyric acid | ||
|---|---|---|---|---|
| CAS Number | 348-75-4 | Molecular Weight | 156.10300 | |
| Density | N/A | Boiling Point | 90 °C | |
| Molecular Formula | C5H7F3O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 90-91°C/25mm | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4,4,4-trifluoro-3-methylbutanoic 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.
| Boiling Point | 90 °C |
|---|---|
| Molecular Formula | C5H7F3O2 |
| Molecular Weight | 156.10300 |
| Flash Point | 90-91°C/25mm |
| Exact Mass | 156.04000 |
| PSA | 37.30000 |
| LogP | 1.65950 |
| Index of Refraction | 1.359 |
| InChIKey | FFZMMBKGTNDVRX-UHFFFAOYSA-N |
| SMILES | CC(CC(=O)O)C(F)(F)F |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | C: Corrosive; |
|---|---|
| Risk Phrases | R34 |
| Safety Phrases | S26-S36/37/39-S45 |
| RIDADR | 3265 |
| Packaging Group | II |
| Hazard Class | 8 |
| HS Code | 2915900090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~%
3-Trifluorometh... CAS#:348-75-4 |
| Literature: Angewandte Chemie - International Edition, , vol. 52, # 52 p. 14191 - 14195 Angew. Chem., , vol. 125, # 52 p. 14441 - 14445,5 |
|
~%
3-Trifluorometh... CAS#:348-75-4 |
| Literature: Journal of the American Chemical Society, , vol. 77, p. 3637,3639 |
|
~%
3-Trifluorometh... CAS#:348-75-4 |
| Literature: Journal of the American Chemical Society, , vol. 77, p. 3637,3639 |
|
~%
3-Trifluorometh... CAS#:348-75-4 |
| Literature: Angewandte Chemie - International Edition, , vol. 52, # 52 p. 14191 - 14195 Angew. Chem., , vol. 125, # 52 p. 14441 - 14445,5 |
|
~%
3-Trifluorometh... CAS#:348-75-4 |
| Literature: Journal of Pharmaceutical Sciences, , vol. 75, # 10 p. 987 - 991 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2915900090 |
|---|---|
| Summary | 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives 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:5.5% General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4,4,4-trifluoro-3-methyl butanoic acid |
| 3-(trifluoromethyl)butanoic acid |
| MFCD00039533 |
| 3-Trifluoromethylbutyric acid |
| 4,4,4-trifluoro-3-methyl-butyric acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: LogP of 4,4,4-trifluoro-3-methylbutanoic acid is 1.65950. |
| Q: What is the safety information for 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: Safety information for 4,4,4-trifluoro-3-methylbutanoic acid: S26-S36/37/39-S45. |
| Q: What is the CAS number of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: CAS number of 4,4,4-trifluoro-3-methylbutanoic acid is 348-75-4. |
| Q: What is the InChIKey of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: InChIKey of 4,4,4-trifluoro-3-methylbutanoic acid is FFZMMBKGTNDVRX-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: Polar surface area (PSA) of 4,4,4-trifluoro-3-methylbutanoic acid is 37.30000. |
| Q: What is the SMILES notation of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: SMILES notation of 4,4,4-trifluoro-3-methylbutanoic acid is CC(CC(=O)O)C(F)(F)F. |
| Q: What English synonyms does 4,4,4-trifluoro-3-methylbutanoic acid have? |
| A: English synonyms of 4,4,4-trifluoro-3-methylbutanoic acid: 4,4,4-trifluoro-3-methyl butanoic acid, 3-(trifluoromethyl)butanoic acid, MFCD00039533, 3-Trifluoromethylbutyric acid, 4,4,4-trifluoro-3-methyl-butyric acid. |
| Q: What is the English name of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: The English name of 4,4,4-trifluoro-3-methylbutanoic acid is 4,4,4-trifluoro-3-methylbutanoic acid. |
| Q: What is the molecular weight of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: Molecular weight of 4,4,4-trifluoro-3-methylbutanoic acid is 156.10300. |
| Q: What is the molecular formula of 4,4,4-trifluoro-3-methylbutanoic acid? |
| A: Molecular formula of 4,4,4-trifluoro-3-methylbutanoic acid is C5H7F3O2. |
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. |