1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one,(E)-but-2-enedioic acid
Modify Date: 2025-08-20 19:13:50
![1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one,(E)-but-2-enedioic acid Structure](https://image.chemsrc.com/caspic/284/18900-05-5.png)
1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one,(E)-but-2-enedioic acid structure
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Common Name | 1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one,(E)-but-2-enedioic acid | ||
|---|---|---|---|---|
| CAS Number | 18900-05-5 | Molecular Weight | 816.89100 | |
| Density | N/A | Boiling Point | 402.3ºC at 760 mmHg | |
| Molecular Formula | C40H56N4O14 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 176.9ºC | |
| Name | 1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one,(E)-but-2-enedioic acid |
|---|---|
| Synonym | More Synonyms |
| Boiling Point | 402.3ºC at 760 mmHg |
|---|---|
| Molecular Formula | C40H56N4O14 |
| Molecular Weight | 816.89100 |
| Flash Point | 176.9ºC |
| Exact Mass | 816.37900 |
| PSA | 270.90000 |
| LogP | 1.86340 |
| Vapour Pressure | 1.11E-06mmHg at 25°C |
| InChIKey | KQRWXZVBEPLBQP-VQYXCCSOSA-N |
| SMILES | O=C(O)C=CC(=O)O.O=C(O)C=CC(=O)O.O=C(O)C=CC(=O)O.O=C1CCCN1CC#CCN1CCCCCC1.O=C1CCCN1CC#CCN1CCCCCC1 |
| pn 309 |