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Sodium Orthophenyl Phenol
CAS: 132-27-4 | C12H10NaO
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
132-27-4
Molecular Formula:
C12H10NaO
Molecular Mass:
193.20 g/mol
Names and Synonyms:
Sodium Orthophenyl Phenol
[1,1′-Biphenyl]-2-ol, sodium salt (1:1)
2-Biphenylol, sodium salt
[1,1′-Biphenyl]-2-ol, sodium salt
Phenol, o-phenyl-, sodium deriv.
Dowicide A
Dowicide
2-Hydroxydiphenyl sodium
Natriphene
Preventol ON
Sodium 2-hydroxydiphenyl
Sodium o-phenylphenate
Sodium 2-phenylphenate
Sodium o-phenylphenolate
Sodium o-phenylphenoxide
Stopmold B
Topane
o-Phenylphenol sodium salt
2-Phenylphenol sodium salt
SOPP
2-Hydroxybiphenyl sodium salt
Sodium 2-biphenylolate
Sodium o-phenylphenol
Preventol ON extra
Dowicide A Flakes
Mystox WFA
Sodium 2-phenylphenoxide
Deccosol
o-Hydroxybiphenyl sodium salt
Sodium 2-phenylphenol
Bactolyse 74880
Microban Additive P 2
Sodium 2-phenylphenoate
Microban P 2
Sodium orthophenylphenoxide
Sodium orthophenylphenol
Identifiers:
SMILES:
Oc1ccccc1-c1ccccc1.[Na]
InChI:
InChI=1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H;
Key Properties
Melting Point
282 °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 | 193.20 g/mol | CAS Common Chemistry |
| 193.20100000000002 g/mol | RDKit | |
| 193.06293422 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Sodium_orthophenyl_phenol | CAS Common Chemistry |
| Canonical SMILES | [Na].OC=1C=CC=CC1C=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H; | CAS Common Chemistry |
| InChI Key | InChIKey=UQPLZHUFLPDORW-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 282 °C | CAS Common Chemistry |
| Name | Sodium o-phenylphenate | CAS Common Chemistry |
| Sodium orthophenyl phenol | CAS Common Chemistry | |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | 2.678400000000001 | RDKit |
| Molar Refractivity | 59.296800000000026 | RDKit |
