CAS Number22619-35-8
Synonyms3-[3-(4-chlorophenyl)-1-(5-chlorothiophen-2-yl)-3-hydroxypropyl]-2-hydroxy-4h-chromen-4-one; tioclomarol; Tioclomarolum [INN-Latin]; Tioclomarolum; Apegmone; Tioclomarol (INN)
Molecular FormulaC22H16Cl2O4S
Molecular Weight447.33
Density1.519g/cm3
Boiling Point618.9ºC at 760mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 22619-35-8 |
| Catalog No. | 2A-9059763 |
| Chinese Name | 噻氯香豆素 |
| Synonyms | 3-[3-(4-chlorophenyl)-1-(5-chlorothiophen-2-yl)-3-hydroxypropyl]-2-hydroxy-4h-chromen-4-one; tioclomarol; Tioclomarolum [INN-Latin]; Tioclomarolum; Apegmone; Tioclomarol (INN) |
| Molecular Formula | C22H16Cl2O4S |
| Molecular Weight | 447.33 |
| Density | 1.519g/cm3 |
| Boiling Point | 618.9ºC at 760mmHg |
| Application | Thioclomalol is a coumarin anticoagulant and a vitamin K antagonist [1]. |
| SMILES | O=c1oc2ccccc2c(O)c1C(CC(O)c1ccc(Cl)cc1)c1ccc(Cl)s1 |
| InChI | InChI=1S/C22H16Cl2O4S/c23-13-7-5-12(6-8-13)16(25)11-15(18-9-10-19(24)29-18)20-21(26)14-3-1-2-4-17(14)28-22(20)27/h1-10,15-16,25,27H,11H2 |
| InChI Key | WRGOVNKNTPWHLZ-UHFFFAOYSA-N |
| Transport Info | Product Name: Ticloprolol |
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