MWJ
Summary
| Name: | 4-bromo-2-methylphenol |
| Formula: | C7 H7 Br O |
| Formal charge: | 0 |
| Formula weight: | 187.034 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-bromo-2-methylphenol |
| OpenEye OEToolkits | 2.0.7 | 4-bromanyl-2-methyl-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1cc(cc(C)c1O)Br |
| InChI | InChI | 1.03 | InChI=1S/C7H7BrO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H3 |
| InChIKey | InChI | 1.03 | IWJGMJHAIUBWKT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(Br)ccc1O |
| SMILES | CACTVS | 3.385 | Cc1cc(Br)ccc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1O)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1O)Br |
