Introduction：Basic information about CAS 42076-13-1|3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one |
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| CAS Number | 42076-13-1 | Molecular Weight | 314.42500 |
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| Density | 1.45g/cm3 | Boiling Point | 522.9ºC at 760 mmHg |
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| Molecular Formula | C16H14N2OS2 | Melting Point | / |
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| MSDS | / | Flash Point | 270ºC |
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Names
| Name | 3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.45g/cm3 |
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| Boiling Point | 522.9ºC at 760 mmHg |
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| Molecular Formula | C16H14N2OS2 |
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| Molecular Weight | 314.42500 |
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| Flash Point | 270ºC |
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| Exact Mass | 314.05500 |
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| PSA | 101.93000 |
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| LogP | 3.61470 |
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| Index of Refraction | 1.75 |
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| InChIKey | VVTUPMPBYOGHJF-UHFFFAOYSA-N |
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| SMILES | O=c1c2c3c(sc2[nH]c(=S)n1-c1ccccc1)CCCC3 |
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Safety Information
Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 2-mercapto-3-phenyl-4-oxo-5,6-tetramethylenothieno<2,3-d>pyrimidine |
| 3-phenyl-2-thio-4-oxo-3,4,5,6,7,8-hexahydrobenzo<b>thieno<2,3-d>pyrimidine |
| 2-Mercapto-3-phenyl-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one |
| 3-phenyl-2-thioxo-2,3,5,6,7,8-hexahydro-1H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one |
| 2-mercapto-3-phenyl-5,6,7,8-tetrahydrobenzo[b]thieno-[2,3-d]pyrimidin-4(3H)-one |
| 2-mercapto-3-phenyl-5,6,7,8-tetrahydrobenzo[b]thieno[2,3-d]pyrimid-4(3H)-one |
| 3-phenyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
