| Melting point |
231-232° (U.S. patent); mp 238-239° (P'an) |
| Boiling point |
680.6±65.0 °C(Predicted) |
| Density |
1.4176 (rough estimate) |
| refractive index |
1.6100 (estimate) |
| storage temp. |
Refrigerator |
| solubility |
DMSO (Slightly), Methanol (Slightly) |
| form |
Solid |
| pka |
9.57±0.20(Predicted) |
| color |
White to Off-White |
| Water Solubility |
2.8mg/L(room temperature) |
| InChI |
1S/C15H14ClN3O4S3/c16-11-6-12-14(7-13(11)25(17,20)21)26(22,23)19-15(18-12)9-24-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,18,19)(H2,17,20,21) |
| InChIKey |
NDTSRXAMMQDVSW-UHFFFAOYSA-N |
| SMILES |
NS(=O)(=O)c1cc2c(NC(CSCc3ccccc3)=NS2(=O)=O)cc1Cl |
| EPA Substance Registry System |
2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3-[[(phenylmethyl)thio]methyl]-, 1,1-dioxide (91-33-8) |
