3-phenylpropyl 3-methylbut-2-enoate
3-phenylpropyl 3-methylbut-2-enoate structure
|
Common Name | 3-phenylpropyl 3-methylbut-2-enoate | ||
|---|---|---|---|---|
| CAS Number | 56500-48-2 | Molecular Weight | 218.29200 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C14H18O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 3-Phenylpropyl 3-methylbut-2-enoate (CAS: 56500-48-2, molecular formula: C14H18O2, molecular weight: 218.29200), 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 | 3-phenylpropyl 3-methylbut-2-enoate |
|---|---|
| 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.
| Molecular Formula | C14H18O2 |
|---|---|
| Molecular Weight | 218.29200 |
| Exact Mass | 218.13100 |
| PSA | 26.30000 |
| LogP | 3.12860 |
| InChIKey | SXBYOJZCRBEUTK-UHFFFAOYSA-N |
| SMILES | CC(C)=CC(=O)OCCCc1ccccc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~95%
3-phenylpropyl ... CAS#:56500-48-2 |
| Literature: Shiina, Isamu Tetrahedron, 2004 , vol. 60, # 7 p. 1587 - 1599 |
|
~90%
3-phenylpropyl ... CAS#:56500-48-2 |
| Literature: Mukaiyama, Teruaki; Shiina, Isamu; Miyashita, Mitsutomo Chemistry Letters, 1992 , # 4 p. 625 - 628 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Methyl-2-butenoic acid,3-phenylpropyl ester |
| 2-Butenoic acid,3-methyl-,3-phenylpropyl ester |
| 3-Phenylpropyl 3-methyl-2-butenoate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: CAS number of 3-phenylpropyl 3-methylbut-2-enoate is 56500-48-2. |
| Q: What is the InChIKey of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: InChIKey of 3-phenylpropyl 3-methylbut-2-enoate is SXBYOJZCRBEUTK-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: SMILES notation of 3-phenylpropyl 3-methylbut-2-enoate is CC(C)=CC(=O)OCCCc1ccccc1. |
| Q: What is the English name of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: The English name of 3-phenylpropyl 3-methylbut-2-enoate is 3-phenylpropyl 3-methylbut-2-enoate. |
| Q: What is the molecular weight of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: Molecular weight of 3-phenylpropyl 3-methylbut-2-enoate is 218.29200. |
| Q: What are the upstream materials of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: Related upstream materials(CAS) of 3-phenylpropyl 3-methylbut-2-enoate: 541-47-9;122-97-4;14629-60-8;25436-25-3. |
| Q: What is the LogP of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: LogP of 3-phenylpropyl 3-methylbut-2-enoate is 3.12860. |
| Q: What is the Chinese name of 56500-48-2? |
| A: Chinese name of 56500-48-2 is 56500-48-2. |
| Q: What is the polar surface area (PSA) of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: Polar surface area (PSA) of 3-phenylpropyl 3-methylbut-2-enoate is 26.30000. |
| Q: What is the molecular formula of 3-phenylpropyl 3-methylbut-2-enoate? |
| A: Molecular formula of 3-phenylpropyl 3-methylbut-2-enoate is C14H18O2. |