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2,2′-Dihydroxyazobenzene
CAS: 2050-14-8 | C12H10N2O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2050-14-8
Molecular Formula:
C12H10N2O2
Molecular Mass:
214.22 g/mol
Names and Synonyms:
2,2′-Dihydroxyazobenzene
Phenol, 2,2′-(1,2-diazenediyl)bis-
Phenol, 2,2′-azodi-
Phenol, 2,2′-azobis-
Phenol, o,o′-azodi-
Phenol, o,o′-azobis-
2,2′-(1,2-Diazenediyl)bis[phenol]
o-Azophenol
o,o′-Dihydroxyazobenzene
2,2′-Dihydroxyazobenzene
2,2′-Azodiphenol
2,2′-Azophenol
Azobenzene-2,2′-diol
Azobis(2-hydroxyphenyl)
2,2′-Diazenediyldiphenol
Identifiers:
SMILES:
Oc1ccccc1N=Nc1ccccc1O
InChI:
InChI=1S/C12H10N2O2/c15-11-7-3-1-5-9(11)13-14-10-6-2-4-8-12(10)16/h1-8,15-16H
Key Properties
Melting Point
173 °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 | 214.22 g/mol | CAS Common Chemistry |
| 214.22400000000002 g/mol | RDKit | |
| 214.07422756 g/mol | RDKit | |
| Canonical SMILES | OC=1C=CC=CC1N=NC=2C=CC=CC2O | CAS Common Chemistry |
| InChI | InChI=1S/C12H10N2O2/c15-11-7-3-1-5-9(11)13-14-10-6-2-4-8-12(10)16/h1-8,15-16H | CAS Common Chemistry |
| InChI Key | InChIKey=JFEVWPNAOCPRHQ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 173 °C | CAS Common Chemistry |
| Name | 2,2′-Dihydroxyazobenzene | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 65.18 Ų | RDKit |
| LogP | 3.5132000000000017 | RDKit |
| Molar Refractivity | 60.38960000000003 | RDKit |
