0F9
Summary
| Name: | 4-chloro-2-(1H-pyrazol-3-yl)phenol |
| Formula: | C9 H7 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 194.618 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-chloro-2-(1H-pyrazol-3-yl)phenol |
| OpenEye OEToolkits | 1.7.6 | 4-chloranyl-2-(1H-pyrazol-3-yl)phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc2ccc(O)c(c1nncc1)c2 |
| InChI | InChI | 1.03 | InChI=1S/C9H7ClN2O/c10-6-1-2-9(13)7(5-6)8-3-4-11-12-8/h1-5,13H,(H,11,12) |
| InChIKey | InChI | 1.03 | DMGLUMYOLOAXJY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Oc1ccc(Cl)cc1c2cc[nH]n2 |
| SMILES | CACTVS | 3.370 | Oc1ccc(Cl)cc1c2cc[nH]n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1Cl)c2cc[nH]n2)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1Cl)c2cc[nH]n2)O |
