Introduction:Basic information about CAS 59898-71-4|2-MERCAPTO-3-PHENYL-3,5,6,7,8,9-HEXAHYDRO-10-THIA-1,3-DIAZA-BENZO[A]AZULEN-4-ONE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-MERCAPTO-3-PHENYL-3,5,6,7,8,9-HEXAHYDRO-10-THIA-1,3-DIAZA-BENZO[A]AZULEN-4-ONE |
|---|
| CAS Number | 59898-71-4 | Molecular Weight | 328.45200 |
|---|
| Density | 1.41g/cm3 | Boiling Point | 532ºC at 760 mmHg |
|---|
| Molecular Formula | C17H16N2OS2 | Melting Point | / |
|---|
| MSDS | / | Flash Point | 275.6ºC |
|---|
Names
| Name | 3-phenyl-2-sulfanylidene-1,5,6,7,8,9-hexahydrocyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one |
|---|
Chemical & Physical Properties
| Density | 1.41g/cm3 |
|---|
| Boiling Point | 532ºC at 760 mmHg |
|---|
| Molecular Formula | C17H16N2OS2 |
|---|
| Molecular Weight | 328.45200 |
|---|
| Flash Point | 275.6ºC |
|---|
| Exact Mass | 328.07000 |
|---|
| PSA | 101.93000 |
|---|
| LogP | 4.00480 |
|---|
| Index of Refraction | 1.729 |
|---|
| InChIKey | ZCPNPFBDYUPJBH-UHFFFAOYSA-N |
|---|
| SMILES | O=c1c2c3c(sc2[nH]c(=S)n1-c1ccccc1)CCCCC3 |
|---|
Safety Information
Customs
| HS Code | 2934999090 |
|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
|---|