Picrylthioglycolic acid
2-(2,4,6-trinitrophenyl)sulfanylacetic acid
Also Known As: Picrylthioglycolic acid|Picrylthioglycollic acid|2-(2,4,6-trinitrophenyl)sulfanylacetic acid|Acetic acid, ((2,4,6-trinitrophenyl)thio)-|[(2,4,6-trinitrophenyl)sulfanyl]acetic acid|Acetic acid,2-[(2,4,6-trinitrophenyl)thio]-|2-mercapto-2-(2,4,6-trinitrophenyl)acetic acid
CAS: 77092-93-4
| Molecular Formula | C8H5N3O8S |
|---|---|
| Molecular Weight | 302.97974 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 200.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.97974 |
| Monoisotopic Mass | 302.97974 |
| Heavy Atoms | 20 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 77092-93-4 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])SCC(=O)O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | GKLQRTFYEJZFHP-UHFFFAOYSA-N |
Product Overview
Picrylthioglycolic acid (CAS 77092-93-4), with molecular formula C8H5N3O8S and molecular weight 302.97974 g/mol. IUPAC: 2-(2,4,6-trinitrophenyl)sulfanylacetic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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