GVG
Summary
| Name: | 3-METHYL-4-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 | 10.04 | 3-methyl-4-phenyl-1H-pyrazole |
| OpenEye OEToolkits | 1.5.0 | 3-methyl-4-phenyl-1H-pyrazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2c(c(c1ccccc1)cn2)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1n[nH]cc1c2ccccc2 |
| SMILES | CACTVS | 3.341 | Cc1n[nH]cc1c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c(c[nH]n1)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c(c[nH]n1)c2ccccc2 |
| InChI | InChI | 1.03 | InChI=1S/C10H10N2/c1-8-10(7-11-12-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,11,12) |
| InChIKey | InChI | 1.03 | XTXZCNATVCIKTR-UHFFFAOYSA-N |
