
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 175013-84-0 |
| Catalog No. | 2A-9012776 |
| Chinese Name | 托那博沙 |
| Synonyms | Tonabersat; Tonabersat [BAN,INN]; UNII-2XD9773ZMN; USL-260 |
| Molecular Formula | C20H19ClFNO4 |
| Molecular Weight | 391.82 |
| Purity | ≥98 (HPLC) |
| Density | 1.38g/cm3 |
| Boiling Point | 554.5ºC at 760 mmHg |
| Appearance | powder |
| Storage Condition | 2-8℃ |
| Application | Tonabersat is a gap-junction modulator. |
| PubChem ID | 329825809 |
| MDL Number | MFCD00944458 |
| SMILES | CC(C1=CC=C2C([C@H](NC(C3=CC=C(F)C(Cl)=C3)=O)[C@H](O)C(C)(C)O2)=C1)=O |
| InChI | 1S/C20H19ClFNO4/c1-10(24)11-5-7-16-13(8-11)17(18(25)20(2,3)27-16)23-19(26)12-4-6-15(22)14(21)9-12/h4-9,17-18,25H,1-3H3,(H,23,26)/t17-,18-/m0/s1 |
| InChI Key | XLIIRNOPGJTBJD-ROUUACIJSA-N |
| NACRES Code | NA.77 |
| UNSPSC | 12352202 |
| MSDS | msds/12776_1_175013_84_0.pdf |
| Transport Info | Product name: Tonabersat |
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