3,5-Dinitro-2-[(pyrimidin-2-yl)sulfanyl]benzoic acid
3,5-dinitro-2-pyrimidin-2-ylsulfanylbenzoic acid
Also Known As: 3,5-dinitro-2-pyrimidin-2-ylsulfanylbenzoic acid|3,5-Dinitro-2-[(pyrimidin-2-yl)sulfanyl]benzoic acid
CAS: 73768-60-2
| Molecular Formula | C11H6N4O6S |
|---|---|
| Molecular Weight | 322.0008 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.0008 |
| Monoisotopic Mass | 322.0008 |
| Heavy Atoms | 22 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 73768-60-2 |
|---|---|
| SMILES | C1=CN=C(N=C1)SC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C(=O)O |
| InChIKey | TYIBMKHHXYPKEW-UHFFFAOYSA-N |
Product Overview
3,5-Dinitro-2-[(pyrimidin-2-yl)sulfanyl]benzoic acid (CAS 73768-60-2), with molecular formula C11H6N4O6S and molecular weight 322.0008 g/mol. IUPAC: 3,5-dinitro-2-pyrimidin-2-ylsulfanylbenzoic 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 →
3,5-Dinitro-2-[(pyrimidin-2-yl)sulfanyl]benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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