methyl 6-phenyl-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate
Modify Date: 2025-08-24 20:31:19
methyl 6-phenyl-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate structure
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Common Name | methyl 6-phenyl-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate | ||
|---|---|---|---|---|
| CAS Number | 80311-70-2 | Molecular Weight | 231.29000 | |
| Density | 1.084g/cm3 | Boiling Point | 353ºC at 760 mmHg | |
| Molecular Formula | C14H17NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 167.3ºC | |
| Name | methyl 6-phenyl-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate |
|---|
| Density | 1.084g/cm3 |
|---|---|
| Boiling Point | 353ºC at 760 mmHg |
| Molecular Formula | C14H17NO2 |
| Molecular Weight | 231.29000 |
| Flash Point | 167.3ºC |
| Exact Mass | 231.12600 |
| PSA | 38.33000 |
| LogP | 2.18130 |
| Index of Refraction | 1.531 |
| InChIKey | YRLWFEZZLLAXJM-UHFFFAOYSA-N |
| SMILES | COC(=O)C1CC=C(c2ccccc2)CNC1 |
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~53%
methyl 6-phenyl... CAS#:80311-70-2 |
| Literature: Hassner, Alfred; D'Costa, Rosario; McPhail, Andrew T.; Butler, William Tetrahedron Letters, 1981 , vol. 22, # 38 p. 3691 - 3694 |
| Precursor 1 | |
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| DownStream 0 | |