| Identification | Back Directory | [Name]
2-bromo-4-(2-chlorophenyl)-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine | [CAS]
57801-97-5 | [Synonyms]
Demethylbrotizolam
Brotizolam impurity B CRS
2-bromo-4-(2-chlorophenyl)-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
2-bromo-4-(2-chlorophenyl)-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine (desmethylbrotizolam). | [Molecular Formula]
C14H8BrClN4S | [MOL File]
57801-97-5.mol | [Molecular Weight]
379.66 |
| Chemical Properties | Back Directory | [Melting point ]
216-218 °C(Solv: ethanol (64-17-5)) | [Boiling point ]
544.3±60.0 °C(Predicted) | [density ]
1.84±0.1 g/cm3(Predicted) | [storage temp. ]
2-8°C | [pka]
1.63±0.40(Predicted) | [Major Application]
pharmaceutical (small molecule) | [InChI]
1S/C14H8BrClN4S/c15-11-5-9-13(8-3-1-2-4-10(8)16)17-6-12-19-18-7-20(12)14(9)21-11/h1-5,7H,6H2 | [InChIKey]
JTELAICMLYYCCL-UHFFFAOYSA-N | [SMILES]
[s]1c2c(cc1Br)C(=NCc4[n]2cnn4)c3c(cccc3)Cl |
| Hazard Information | Back Directory | [Uses]
Brotizolam impurity B EP Reference standard, intended for use in laboratory tests only as specifically prescribed in the European Pharmacopoeia. |
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