NSC308005
ethyl 4-bromo-5-oxo-3,4-dihydro-1H-benzo[cd]indole-2-carboxylate
Also Known As: ethyl bromo(oxo)[?]carboxylate|NCI60_002635|ethyl 4-bromo-5-oxo-3,4-dihydro-1H-benzo[cd]indole-2-carboxy|Benz[cd]indole-2-carboxylic acid, 4-bromo-1,3,4, 5-tetrahydro-5-oxo-, ethyl ester|ethyl 4-bromo-5-oxo-3,4-dihydro-1H-benzo[cd]indole-2-carboxylate|Benz[cd]indole-2-carboxylic acid,3,4,5-tetrahydro-5-oxo-, ethyl ester|Ethyl 4-bromo-5-oxo-1,3,4,5-tetrahydrobenzo[cd]indole-2-carboxylate
| Molecular Formula | C14H12BrNO3 |
|---|---|
| Molecular Weight | 321.00006 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 59.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.00006 |
| Monoisotopic Mass | 321.00006 |
| Heavy Atoms | 19 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 65602-77-9 |
|---|---|
| SMILES | CCOC(=O)C1=C2CC(C(=O)C3=C2C(=CC=C3)N1)Br |
| InChIKey | NOTGKWNERPTYSN-UHFFFAOYSA-N |
Product Overview
NSC308005 (CAS 65602-77-9), with molecular formula C14H12BrNO3 and molecular weight 321.00006 g/mol. IUPAC: ethyl 4-bromo-5-oxo-3,4-dihydro-1H-benzo[cd]indole-2-carboxylate.
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