![5-(4-Nitrophenyl)-3H-thieno[2,3-d]pyrimidin-4-one structure, CAS 691366-18-4](/structures/100000/90349_2_691366_18_4.png)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 691366-18-4 |
| Catalog No. | 2A-9090349 |
| Chinese Name | 5-(4-NITROPHENYL)-3H-THIENO[2,3-D]PYRIMIDIN-4-ONE |
| Synonyms | 5-(4-Nitrophenyl)thieno[2,3-d]pyrimidin-4(1H)-one; MFCD00715623 |
| Molecular Formula | C12H7N3O3S |
| Molecular Weight | 273.267 |
| Density | 1.6±0.1 g/cm3 |
| Boiling Point | 537.9±40.0 °C at 760 mmHg |
| PubChem ID | 3187955 |
| SMILES | O=c1[nH]cnc2scc(-c3ccc([N+](=O)[O-])cc3)c12 |
| InChI | InChI=1S/C12H7N3O3S/c16-11-10-9(5-19-12(10)14-6-13-11)7-1-3-8(4-2-7)15(17)18/h1-6H,(H,13,14,16) |
| InChI Key | YADQDJXBCZDQFT-UHFFFAOYSA-N |
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