A1ATB
Summary
| Name: | (propan-2-yl)benzene |
| Formula: | C9 H12 |
| Formal charge: | 0 |
| Formula weight: | 120.192 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (propan-2-yl)benzene |
| OpenEye OEToolkits | 2.0.7 | propan-2-ylbenzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CC(C)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3 |
| InChIKey | InChI | 1.06 | RWGFKTVRMDUZSP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)c1ccccc1 |
| SMILES | CACTVS | 3.385 | CC(C)c1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)c1ccccc1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)c1ccccc1 |
