Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI) structure
|
Common Name | Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI) | ||
|---|---|---|---|---|
| CAS Number | 583021-12-9 | Molecular Weight | 373.405 | |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 634.7±55.0 °C at 760 mmHg | |
| Molecular Formula | C22H19N3O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 337.7±31.5 °C | |
| Name | 4-[3-(1-Benzofuran-2-yl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]benzoic acid |
|---|---|
| Synonym | More Synonyms |
| Density | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 634.7±55.0 °C at 760 mmHg |
| Molecular Formula | C22H19N3O3 |
| Molecular Weight | 373.405 |
| Flash Point | 337.7±31.5 °C |
| Exact Mass | 373.142639 |
| LogP | 5.83 |
| Vapour Pressure | 0.0±2.0 mmHg at 25°C |
| Index of Refraction | 1.716 |
| InChIKey | XAMKYLDAYUGTLA-UHFFFAOYSA-N |
| SMILES | O=C(O)c1ccc(-n2nc(-c3cc4ccccc4o3)c3c2NCCCC3)cc1 |
| Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- |
| 4-[3-(1-Benzofuran-2-yl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]benzoic acid |