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| IUPAC Name: | (3-nitrophenyl)methanethiol |
| Description: | (3-Nitrobenzyl)mercaptan (CAS# 77472-39-0 ) is a useful research chemical. |
| Molecular Weight: | 169.20 |
| Molecular Formula: | C7H7NO2S |
| Canonical SMILES: | C1=CC(=CC(=C1)[N+](=O)[O-])CS |
| InChI: | InChI=1S/C7H7NO2S/c9-8(10)7-3-1-2-6(4-7)5-11/h1-4,11H,5H2 |
| InChI Key: | MNNASYKPIIJEJF-UHFFFAOYSA-N |
| Boiling Point: | 308.5 °C at 760 mmHg |
| Density: | 1.285 g/cm3 |
| MDL: | MFCD00024542 |
| LogP: | 2.54780 |
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