
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 202420-04-0 |
| Catalog No. | 2A-1199264 |
| Chinese Name | 氯化甲基苯骈三氮唑 |
| Synonyms | Tolutriazole chloride |
| Molecular Formula | C7H6ClN3.Na |
| Molecular Weight | 458.93 (anhydrous basis) |
| Purity | ≥98 (HPLC) |
| Appearance | powder |
| PubChem ID | 24899985 |
| SMILES | O.[Na+].CN1c2ccccc2C(NCCCCCCC([O-])=O)c3ccc(Cl)cc3S1(=O)=O |
| InChI | 1S/C21H25ClN2O4S.Na.H2O/c1-24-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(25)26)17-12-11-15(22)14-19(17)29(24,27)28;;/h5-6,8-9,11-12,14,21,23H,2-4,7,10,13H2,1H3,(H,25,26);;1H2/q;+1;/p-1 |
| InChI Key | HNTRDGDHBBFLPG-UHFFFAOYSA-M |
| NACRES Code | NA.77 |
| UNSPSC | 12352200 |
| MSDS | msds/201235_1_202420_04_0.pdf |
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