BCP
Summary
| Name: | 2-BROMO-6-CHLORO-PURINE |
| Formula: | C5 H2 Br Cl N4 |
| Formal charge: | 0 |
| Formula weight: | 233.453 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-bromo-6-chloro-7H-purine |
| OpenEye OEToolkits | 1.5.0 | 2-bromo-6-chloro-7H-purine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Clc1nc(Br)nc2ncnc12 |
| SMILES_CANONICAL | CACTVS | 3.341 | Clc1nc(Br)nc2nc[nH]c12 |
| SMILES | CACTVS | 3.341 | Clc1nc(Br)nc2nc[nH]c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)nc(nc2Cl)Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)nc(nc2Cl)Br |
| InChI | InChI | 1.03 | InChI=1S/C5H2BrClN4/c6-5-10-3(7)2-4(11-5)9-1-8-2/h1H,(H,8,9,10,11) |
| InChIKey | InChI | 1.03 | VLGHYTLGJNPTEN-UHFFFAOYSA-N |
