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Salicylanilide
CAS: 87-17-2 | C13H11NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
87-17-2
Molecular Formula:
C13H11NO2
Molecular Mass:
213.24 g/mol
Names and Synonyms:
Salicylanilide
Benzamide, 2-hydroxy-N-phenyl-
Salicylanilide
2-Hydroxy-N-phenylbenzamide
Ansadol
Aseptolan
o-Hydroxybenzanilide
2-Hydroxybenzanilide
Salicylanilid
Salinide
Salinidol
Salnide
Shirlan AG
Shirlan
Shirlan Extra
Salicylic acid anilide
N-Phenylsalicylamide
Sherstat SLN
Hyanilid
Salifebrin
WR 10019
2-(N-Phenylcarboxamido)phenol
SA 88
2-(Phenylaminocarbonyl)phenol
N-Phenyl-2-hydroxybenzamide
NSC 14881
SA 88 (biocide)
Identifiers:
SMILES:
OC(=Nc1ccccc1)c1ccccc1O
InChI:
InChI=1S/C13H11NO2/c15-12-9-5-4-8-11(12)13(16)14-10-6-2-1-3-7-10/h1-9,15H,(H,14,16)
Key Properties
Melting Point
136.5 °C
CAS Common Chemistry
Density
1.33 g/cm³
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 | 213.24 g/mol | CAS Common Chemistry |
| 213.236 g/mol | RDKit | |
| 213.078978592 g/mol | RDKit | |
| Density | 1.33 g/cm³ | CAS Common Chemistry |
| 1.33 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Salicylanilide | CAS Common Chemistry |
| Canonical SMILES | O=C(NC=1C=CC=CC1)C=2C=CC=CC2O | CAS Common Chemistry |
| InChI | InChI=1S/C13H11NO2/c15-12-9-5-4-8-11(12)13(16)14-10-6-2-1-3-7-10/h1-9,15H,(H,14,16) | CAS Common Chemistry |
| InChI Key | InChIKey=WKEDVNSFRWHDNR-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 136.5 °C | CAS Common Chemistry |
| Name | Salicylanilide | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 52.82000000000001 Ų | RDKit |
| LogP | 3.0285000000000015 | RDKit |
| Molar Refractivity | 63.37460000000003 | RDKit |
