ISO
Summary
| Name: | PARA-ISOPROPYLANILINE |
| Formula: | C9 H13 N |
| Formal charge: | 0 |
| Formula weight: | 135.206 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(propan-2-yl)aniline |
| OpenEye OEToolkits | 1.7.0 | 4-propan-2-ylaniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Nc1ccc(cc1)C(C)C |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(C)c1ccc(N)cc1 |
| SMILES | CACTVS | 3.370 | CC(C)c1ccc(N)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC(C)c1ccc(cc1)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)c1ccc(cc1)N |
| InChI | InChI | 1.03 | InChI=1S/C9H13N/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,10H2,1-2H3 |
| InChIKey | InChI | 1.03 | LRTFPLFDLJYEKT-UHFFFAOYSA-N |
