
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1030377-31-1 |
| Catalog No. | 2A-2187593 |
| Chinese Name | Suvorexant intermediate |
| Synonyms | Benzyl (5R)-5-methyl-4-[5-methyl-2-(2H-1,2,3-triazol-2-yl)benzoyl]-1,4-diazepane-1-carboxylate |
| Molecular Formula | C24H27O3N5 |
| Molecular Weight | 433.51 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 649.0±65.0 °C at 760 mmHg |
| PubChem ID | 99307780 |
| MDL Number | MFCD22419983 |
| SMILES | Cc1ccc(-n2nccn2)c(C(=O)N2CCN(C(=O)OCc3ccccc3)CCC2C)c1 |
| InChI | InChI=1S/C24H27N5O3/c1-18-8-9-22(29-25-11-12-26-29)21(16-18)23(30)28-15-14-27(13-10-19(28)2)24(31)32-17-20-6-4-3-5-7-20/h3-9,11-12,16,19H,10,13-15,17H2,1-2H3/t19-/m1/s1 |
| InChI Key | COQWNFCXULWHAR-LJQANCHMSA-N |
| Related Products in Specialty Chemicals | ||
|---|---|---|
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| ORTHO-N-VALERIC ACID TRIETHYL ESTER | 919-29-9 | 2A-0201435 |
| Suvorexant intermediate | 1030377-27-5 | 2A-2187594 |
| Suvorexant intermediate | 1620097-07-5 | 2A-2187596 |
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