| Weight | 290.344 g/mol |
|---|---|
| Formula | C14H14N2O3S |
| Hydrogen Acceptors | 6 |
| Hydrogen Donors | 2 |
| Aromatic Rings | 2 |
| Rotatable Bonds | 4 |
CHEMBL592869 (430447-82-8)
1-(3,4-dihydroxyphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]ethanone · 430447-82-8
Suppliers
Alternate Names
- 1-(3,4-dihydroxyphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]ethanone
- 430447-82-8
-
SMILESCC1=CC(=NC(=N1)SCC(=O)C2=CC(=C(C=C2)O)O)C
-
InChIKeyJQXFBAGVXOGSNK-UHFFFAOYSA-N
Estimated Properties
| Boiling Point | 416.91 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 453.53 C | EPI Suite |
| Density | 1.38 g/cm3 | EPA T.E.S.T. |
| Flash Point | 245.34 C | EPA T.E.S.T. |
| Melting Point | 190.89 C | EPI Suite |
| Water Solubility | 270.14 mg/L | EPA T.E.S.T. |
| Water Solubility | 351 mg/L | EPI Suite |
External Links
- Pubchem - CHEMBL592869
- Wikipedia - 1-(3,4-dihydroxyphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]ethanone
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