Benzenebutanoic acid, a-acetyl-g-oxo-a-(phenylmethyl)-, ethyl ester
Benzenebutanoic acid, a-acetyl-g-oxo-a-(phenylmethyl)-, ethyl ester structure
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Common Name | Benzenebutanoic acid, a-acetyl-g-oxo-a-(phenylmethyl)-, ethyl ester | ||
|---|---|---|---|---|
| CAS Number | 6938-63-2 | Molecular Weight | 338.39700 | |
| Density | 1.136g/cm3 | Boiling Point | 496.2ºC at 760mmHg | |
| Molecular Formula | C21H22O4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 216.9ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate |
|---|---|
| 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 | 1.136g/cm3 |
|---|---|
| Boiling Point | 496.2ºC at 760mmHg |
| Molecular Formula | C21H22O4 |
| Molecular Weight | 338.39700 |
| Flash Point | 216.9ºC |
| Exact Mass | 338.15200 |
| PSA | 60.44000 |
| LogP | 3.64060 |
| Index of Refraction | 1.55 |
| InChIKey | ZGRWQNOZOVODNL-UHFFFAOYSA-N |
| SMILES | CCOC(=O)C(CC(=O)c1ccccc1)(Cc1ccccc1)C(C)=O |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~54%
Benzenebutanoic... CAS#:6938-63-2 |
| Literature: Roessle, Michael; Werner, Thomas; Frey, Wolfgang; Christoffers, Jens European Journal of Organic Chemistry, 2005 , # 23 p. 5031 - 5038 |
|
~33%
Benzenebutanoic... CAS#:6938-63-2 |
| Literature: Clements, Michael T.; McMurry, Brian H. Canadian Journal of Chemistry, 1987 , vol. 65, p. 1810 - 1813 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutyrate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the Chinese name of 6938-63-2? |
| A: Chinese name of 6938-63-2 is 6938-63-2. |
| Q: What is the CAS number of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: CAS number of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is 6938-63-2. |
| Q: What is the molecular weight of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: Molecular weight of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is 338.39700. |
| Q: What is the LogP of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: LogP of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is 3.64060. |
| Q: What is the SMILES notation of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: SMILES notation of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is CCOC(=O)C(CC(=O)c1ccccc1)(Cc1ccccc1)C(C)=O. |
| Q: What is the InChIKey of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: InChIKey of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is ZGRWQNOZOVODNL-UHFFFAOYSA-N. |
| Q: What is the boiling point of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: Boiling point of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is 496.2ºC at 760mmHg. |
| Q: What are the upstream materials of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: Related upstream materials(CAS) of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate: 292638-84-7;620-79-1;70-11-1. |
| Q: What is the molecular formula of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: Molecular formula of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is C21H22O4. |
| Q: What is the polar surface area (PSA) of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate? |
| A: Polar surface area (PSA) of ethyl 2-acetyl-2-benzyl-4-oxo-4-phenylbutanoate is 60.44000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |