3-(3,4,5-Trimethoxyphenyl)thiadiazol-3-ium-4-olate
3-(3,4,5-trimethoxyphenyl)-1λ4-thia-2,3-diazacyclopenta-1,5-dien-4-one
Also Known As: 3-1,2,3-thiadiazol-3-ium-4-olate|3-(3,4,5-trimethoxyphenyl)thiadiazol-3-ium-4-olate|3- -1,2,3-thiadiazol-3-ium-4-olate|3-(3,4,5-Trimethoxyphenyl)-1,2,3-thiadiazol-3-ium-4-olate|3-(3,4,5-trimethoxyphenyl)-1,2,3lambda5-thiadiazol-3-ylium-4-olate|1,2,3-Thiadiazolium, 4-hydroxy-3-(3,4,5-trimethoxyphenyl)-, hydroxide, inner salt
| Molecular Formula | C11H12N2O4S |
|---|---|
| Molecular Weight | 268.0518 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.0518 |
| Monoisotopic Mass | 268.0518 |
| Heavy Atoms | 18 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 41175-64-8 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)N2C(=O)C=S=N2 |
| InChIKey | ACSFYOOEPRLWJA-UHFFFAOYSA-N |
Product Overview
3-(3,4,5-Trimethoxyphenyl)thiadiazol-3-ium-4-olate (CAS 41175-64-8), with molecular formula C11H12N2O4S and molecular weight 268.0518 g/mol. IUPAC: 3-(3,4,5-trimethoxyphenyl)-1λ4-thia-2,3-diazacyclopenta-1,5-dien-4-one.
3-(3,4,5-Trimethoxyphenyl)thiadiazol-3-ium-4-olate is a custom synthesis product. We offer services from milligram to kilogram scale.
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