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| IUPAC Name: | 2-(2-cyanophenyl)sulfanylbenzoic acid |
| Description: | 2-(2-Cyanophenylthio)benzoic acid (CAS# 163725-12-0) is a useful research chemical. |
| Molecular Weight: | 255.29 |
| Molecular Formula: | C14H9NO2S |
| Canonical SMILES: | C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)O |
| InChI: | InChI=1S/C14H9NO2S/c15-9-10-5-1-3-7-12(10)18-13-8-4-2-6-11(13)14(16)17/h1-8H,(H,16,17) |
| InChI Key: | FMGHXZOIAXNGOL-UHFFFAOYSA-N |
| Boiling Point: | 423.7 °C at 760 mmHg |
| Density: | 1.38 g/cm3 |
| MDL: | MFCD00075348 |
| LogP: | 3.40768 |
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