Methyl 3,3,3-trifluoroalaninate
Methyl 3,3,3-trifluoroalaninate structure
|
Common Name | Methyl 3,3,3-trifluoroalaninate | ||
|---|---|---|---|---|
| CAS Number | 27240-44-4 | Molecular Weight | 157.091 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 147.5±35.0 °C at 760 mmHg | |
| Molecular Formula | C4H6F3NO2 | Melting Point | 168-170ºC | |
| MSDS | N/A | Flash Point | 43.0±25.9 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | methyl 2-amino-3,3,3-trifluoropropanoate |
|---|---|
| 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 | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 147.5±35.0 °C at 760 mmHg |
| Melting Point | 168-170ºC |
| Molecular Formula | C4H6F3NO2 |
| Molecular Weight | 157.091 |
| Flash Point | 43.0±25.9 °C |
| Exact Mass | 157.035065 |
| PSA | 52.32000 |
| LogP | 0.80 |
| Vapour Pressure | 4.4±0.3 mmHg at 25°C |
| Index of Refraction | 1.362 |
| InChIKey | MPSBBPUJPYCDGC-UHFFFAOYSA-N |
| SMILES | COC(=O)C(N)C(F)(F)F |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~95%
Methyl 3,3,3-tr... CAS#:27240-44-4 |
| Literature: Burger, Klaus; Hoess, Eva; Gaa, Karl; Sewald, Norbert; Schierlinger, Christian Zeitschrift fuer Naturforschung, B: Chemical Sciences, 1991 , vol. 46, # 3 p. 361 - 384 |
|
~%
Methyl 3,3,3-tr... CAS#:27240-44-4 |
| Literature: Weygand,F. et al. Chemische Berichte, 1970 , vol. 103, # 6 p. 1655 - 1663 |
![METHYL N-[(BENZYLOXY)CARBONYL]-3,3,3-TRIFLUOROALANINATE structure](https://image.chemsrc.com/caspic/225/27240-49-9.png)
This 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3,3,3-Trifluoroalaninmethylester |
| Methyl 3,3,3-trifluoroalaninate |
| Alanine, 3,3,3-trifluoro-, methyl ester |
| MFCD07779869 |
| 3,3,3-Trifluor-alanin-methylester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the melting point of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: Melting point of methyl 2-amino-3,3,3-trifluoropropanoate is 168-170ºC. |
| Q: What is the polar surface area (PSA) of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: Polar surface area (PSA) of methyl 2-amino-3,3,3-trifluoropropanoate is 52.32000. |
| Q: What is the SMILES notation of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: SMILES notation of methyl 2-amino-3,3,3-trifluoropropanoate is COC(=O)C(N)C(F)(F)F. |
| Q: What is the InChIKey of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: InChIKey of methyl 2-amino-3,3,3-trifluoropropanoate is MPSBBPUJPYCDGC-UHFFFAOYSA-N. |
| Q: What is the safety information for methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: Safety information for methyl 2-amino-3,3,3-trifluoropropanoate: 22-24/25. |
| Q: What is the English name of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: The English name of methyl 2-amino-3,3,3-trifluoropropanoate is methyl 2-amino-3,3,3-trifluoropropanoate. |
| Q: What is the molecular weight of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: Molecular weight of methyl 2-amino-3,3,3-trifluoropropanoate is 157.091. |
| Q: What is the boiling point of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: Boiling point of methyl 2-amino-3,3,3-trifluoropropanoate is 147.5±35.0 °C at 760 mmHg. |
| Q: What is the LogP of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: LogP of methyl 2-amino-3,3,3-trifluoropropanoate is 0.80. |
| Q: What is the CAS number of methyl 2-amino-3,3,3-trifluoropropanoate? |
| A: CAS number of methyl 2-amino-3,3,3-trifluoropropanoate is 27240-44-4. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |