Methyl 4,4,4-trifluoro-3-oxobutanoate
Methyl 4,4,4-trifluoro-3-oxobutanoate structure
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Common Name | Methyl 4,4,4-trifluoro-3-oxobutanoate | ||
|---|---|---|---|---|
| CAS Number | 83643-84-9 | Molecular Weight | 170.087 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 117.4±35.0 °C at 760 mmHg | |
| Molecular Formula | C5H5F3O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 25.1±20.8 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Methyl 4,4,4-Trifluoroacetoacetate |
|---|---|
| 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 | 117.4±35.0 °C at 760 mmHg |
| Molecular Formula | C5H5F3O3 |
| Molecular Weight | 170.087 |
| Flash Point | 25.1±20.8 °C |
| Exact Mass | 170.019073 |
| PSA | 43.37000 |
| LogP | 1.93 |
| Vapour Pressure | 17.4±0.2 mmHg at 25°C |
| Index of Refraction | 1.349 |
| InChIKey | LKMUBWWZTSZGGV-UHFFFAOYSA-N |
| SMILES | COC(=O)CC(=O)C(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.
| Hazard Codes | Xn:Harmful; |
|---|---|
| Risk Phrases | R10;R22;R36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | UN 3272 3/PG 3 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 3 |
| HS Code | 2918300090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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Methyl 4,4,4-tr... CAS#:83643-84-9 |
| Literature: Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), , vol. 35, # 4 p. 799 - 804 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, , # 4 p. 879 - 884 |
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~%
Methyl 4,4,4-tr... CAS#:83643-84-9 |
| Literature: Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), , vol. 35, # 4 p. 799 - 804 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, , # 4 p. 879 - 884 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 1 | |
|---|---|
| DownStream 10 | |
CAS#:3335-46-4
CAS#:193610-95-6
CAS#:2070-87-3
CAS#:60-35-5
CAS#:354-38-1
CAS#:107638-26-6
CAS#:59-67-6
CAS#:26717-91-9
CAS#:96145-98-1
CAS#:748746-28-3This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2918300090 |
|---|---|
| Summary | 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Methyl-4,4,4-trifluoro-3-oxobutanoate |
| Butanoic acid,4,4,4-trifluoro-3-oxo-,methyl ester |
| Methyl 4,4,4-trifluoro-3-oxobutanoate |
| Butanoic acid, 4,4,4-trifluoro-3-oxo-, methyl ester |
| methyl 4,4,4-trifluoroacetoacetate |
| MFCD00041004 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: Related downstream products(CAS) of Methyl 4,4,4-Trifluoroacetoacetate: 3335-46-4;193610-95-6;2070-87-3;60-35-5;354-38-1;107638-26-6;59-67-6;26717-91-9;96145-98-1;748746-28-3. |
| Q: What are the upstream materials of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: Related upstream materials(CAS) of Methyl 4,4,4-Trifluoroacetoacetate: 106775-98-8. |
| Q: What English synonyms does Methyl 4,4,4-Trifluoroacetoacetate have? |
| A: English synonyms of Methyl 4,4,4-Trifluoroacetoacetate: Methyl-4,4,4-trifluoro-3-oxobutanoate, Butanoic acid,4,4,4-trifluoro-3-oxo-,methyl ester, Methyl 4,4,4-trifluoro-3-oxobutanoate, Butanoic acid, 4,4,4-trifluoro-3-oxo-, methyl ester, methyl 4,4,4-trifluoroacetoacetate, MFCD00041004. |
| Q: What is the safety information for Methyl 4,4,4-Trifluoroacetoacetate? |
| A: Safety information for Methyl 4,4,4-Trifluoroacetoacetate: S26-S36. |
| Q: What is the CAS number of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: CAS number of Methyl 4,4,4-Trifluoroacetoacetate is 83643-84-9. |
| Q: What is the molecular weight of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: Molecular weight of Methyl 4,4,4-Trifluoroacetoacetate is 170.087. |
| Q: What is the polar surface area (PSA) of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: Polar surface area (PSA) of Methyl 4,4,4-Trifluoroacetoacetate is 43.37000. |
| Q: What is the SMILES notation of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: SMILES notation of Methyl 4,4,4-Trifluoroacetoacetate is COC(=O)CC(=O)C(F)(F)F. |
| Q: What is the InChIKey of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: InChIKey of Methyl 4,4,4-Trifluoroacetoacetate is LKMUBWWZTSZGGV-UHFFFAOYSA-N. |
| Q: What is the LogP of Methyl 4,4,4-Trifluoroacetoacetate? |
| A: LogP of Methyl 4,4,4-Trifluoroacetoacetate is 1.93. |
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. |