Introduction:Basic information about CAS 59898-68-9|3-BENZYL-2-MERCAPTO-5,6,7,8-TETRAHYDRO-3H-BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-O, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-BENZYL-2-MERCAPTO-5,6,7,8-TETRAHYDRO-3H-BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE |
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| CAS Number | 59898-68-9 | Molecular Weight | 328.45200 |
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| Density | 1.41g/cm3 | Boiling Point | 545.5ºC at 760 mmHg |
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| Molecular Formula | C17H16N2OS2 | Melting Point | / |
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| MSDS | / | Flash Point | 283.7ºC |
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Names
| Name | 3-benzyl-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 | 1.41g/cm3 |
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| Boiling Point | 545.5ºC at 760 mmHg |
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| Molecular Formula | C17H16N2OS2 |
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| Molecular Weight | 328.45200 |
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| Flash Point | 283.7ºC |
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| Exact Mass | 328.07000 |
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| PSA | 101.93000 |
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| LogP | 3.67380 |
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| Index of Refraction | 1.729 |
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| InChIKey | SHYFDWYGFKOVKX-UHFFFAOYSA-N |
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| SMILES | O=c1c2c3c(sc2[nH]c(=S)n1Cc1ccccc1)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-benzyl-4-oxo-5,6-tetramethylenothieno<2,3-d>pyrimidine |