Compound C9H8BrN5O3
(1R,10S,11S)-11-azido-4-bromo-8,13-dioxa-2,6-diazatricyclo[8.2.1.02,7]trideca-3,6-dien-5-one
| Molecular Formula | C9H8BrN5O3 |
|---|---|
| Molecular Weight | 314.1 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 65.5 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.98105 |
| Heavy Atoms | 18 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 120826-43-9 |
|---|---|
| SMILES | C1C(C2COC3=NC(=O)C(=CN3C1O2)Br)N=[N+]=[N-] |
| InChIKey | IKQPIXUQCPAHRU-RRKCRQDMSA-N |
📖 Product Overview
Compound C9H8BrN5O3 (CAS: 120826-43-9) is a chemical compound with molecular formula C9H8BrN5O3 and molecular weight 314.1 g/mol. Its IUPAC systematic name is (1R,10S,11S)-11-azido-4-bromo-8,13-dioxa-2,6-diazatricyclo[8.2.1.02,7]trideca-3,6-dien-5-one.
IKQPIXUQCPAHRU-RRKCRQDMSA-N.
SMILES: C1C(C2COC3=NC(=O)C(=CN3C1O2)Br)N=[N+]=[N-].
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