H3R
Summary
| Name: | 5-METHYL-3-PHENYL-1H-PYRAZOLE |
| Formula: | C10 H10 N2 |
| Formal charge: | 0 |
| Formula weight: | 158.2 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-methyl-5-phenyl-1H-pyrazole |
| OpenEye OEToolkits | 1.9.2 | 3-methyl-5-phenyl-1H-pyrazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2c(cc(c1ccccc1)n2)C |
| InChI | InChI | 1.03 | InChI=1S/C10H10N2/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,11,12) |
| InChIKey | InChI | 1.03 | QHRSESMSOJZMCO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc([nH]n1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | Cc1cc([nH]n1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1cc([nH]n1)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 1.9.2 | Cc1cc([nH]n1)c2ccccc2 |
