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1H-Indazol-5-Ol
CAS: 15579-15-4 | C7H6N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
15579-15-4
Molecular Formula:
C7H6N2O
Molecular Mass:
134.14 g/mol
Names and Synonyms:
1H-Indazol-5-Ol
1H-Indazol-5-ol
5-Indazolol
5-Hydroxyindazole
5-Hydroxy-1H-indazole
NSC 520104
Identifiers:
SMILES:
Oc1ccc2[nH]ncc2c1
InChI:
InChI=1S/C7H6N2O/c10-6-1-2-7-5(3-6)4-8-9-7/h1-4,10H,(H,8,9)
Key Properties
Melting Point
184 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 134.14 g/mol | CAS Common Chemistry |
| 134.138 g/mol | RDKit | |
| 134.048012812 g/mol | RDKit | |
| Canonical SMILES | OC=1C=CC=2NN=CC2C1 | CAS Common Chemistry |
| InChI | InChI=1S/C7H6N2O/c10-6-1-2-7-5(3-6)4-8-9-7/h1-4,10H,(H,8,9) | CAS Common Chemistry |
| InChI Key | InChIKey=ZHDXWEPRYNHNDC-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 184 °C | CAS Common Chemistry |
| Name | 1H-Indazol-5-ol | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 48.91 Ų | RDKit |
| LogP | 1.2685 | RDKit |
| Molar Refractivity | 37.758500000000005 | RDKit |
