4-Pyrimidinecarboxaldehyde,1,2,3,6-tetrahydro-5-[(4-nitrophenyl)methyl]-6-oxo-2-thioxo- structure
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Common Name | 4-Pyrimidinecarboxaldehyde,1,2,3,6-tetrahydro-5-[(4-nitrophenyl)methyl]-6-oxo-2-thioxo- | ||
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| CAS Number | 21326-32-9 | Molecular Weight | 291.28300 | |
| Density | 1.53g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C12H9N3O4S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 5-[(4-nitrophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde |
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| Synonym | More Synonyms |
| Density | 1.53g/cm3 |
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| Molecular Formula | C12H9N3O4S |
| Molecular Weight | 291.28300 |
| Exact Mass | 291.03100 |
| PSA | 143.63000 |
| LogP | 2.26720 |
| Index of Refraction | 1.695 |
| InChIKey | HOISYRASTCTZAZ-UHFFFAOYSA-N |
| SMILES | O=Cc1[nH]c(=S)[nH]c(=O)c1Cc1ccc([N+](=O)[O-])cc1 |
| 5-(4-nitro-benzyl)-6-oxo-2-thioxo-1,2,3,6-tetrahydro-pyrimidine-4-carbaldehyde |