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Molecule
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
Identifiers
CAS Registry Number
87-17-2
SMILES
OC(=Nc1ccccc1)c1ccccc1O
InChI Key
WKEDVNSFRWHDNR-UHFFFAOYSA-N
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)
Names and Synonyms
- Salicylanilide Common Name
- Salicylanilide Synonym
- Benzamide, 2-hydroxy-N-phenyl- Synonym
- 2-Hydroxy-N-phenylbenzamide Synonym
- Ansadol Synonym
- Aseptolan Synonym
- o-Hydroxybenzanilide Synonym
- 2-Hydroxybenzanilide Synonym
- Salicylanilid Synonym
- Salinide Synonym
- Salinidol Synonym
- Salnide Synonym
- Shirlan AG Synonym
- Shirlan Synonym
- Shirlan Extra Synonym
- Salicylic acid anilide Synonym
- N-Phenylsalicylamide Synonym
- Sherstat SLN Synonym
- Hyanilid Synonym
- Salifebrin Synonym
- WR 10019 Synonym
- 2-(N-Phenylcarboxamido)phenol Synonym
- SA 88 Synonym
- 2-(Phenylaminocarbonyl)phenol Synonym
- N-Phenyl-2-hydroxybenzamide Synonym
- NSC 14881 Synonym
- SA 88 (biocide) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 213.24 g/mol | CAS Common Chemistry |
| 213.236 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 |
| 52.82 Ų | RDKit | |
| LogP | 3.0285000000000015 | RDKit |
| 3.0285 | RDKit | |
| Molar Refractivity | 63.37460000000003 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 213.078978592 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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5
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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.
External Resources
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Quick conversion
MW = 213.24 g/mol; density = 1.330 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C13H11NO2.
