2IB
Summary
| Name: | 2-IODOBENZYL GROUP |
| Formula: | C7 H7 I |
| Formal charge: | 0 |
| Formula weight: | 218.035 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-iodo-2-methylbenzene |
| OpenEye OEToolkits | 1.5.0 | 1-iodo-2-methyl-benzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Ic1ccccc1C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1ccccc1I |
| SMILES | CACTVS | 3.341 | Cc1ccccc1I |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1ccccc1I |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1ccccc1I |
| InChI | InChI | 1.03 | InChI=1S/C7H7I/c1-6-4-2-3-5-7(6)8/h2-5H,1H3 |
| InChIKey | InChI | 1.03 | RINOYHWVBUKAQE-UHFFFAOYSA-N |
