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| IUPAC Name: | sodium;3,5-bis(methoxycarbonyl)benzenesulfonate |
| Description: | Dimethyl 5-sulfoisophthalate sodium salt (CAS# 3965-55-7) is a useful research chemical. |
| Molecular Weight: | 296.23 |
| Molecular Formula: | C10H9NaO7S |
| Canonical SMILES: | COC(=O)C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)OC.[Na+] |
| InChI: | InChI=1S/C10H10O7S.Na/c1-16-9(11)6-3-7(10(12)17-2)5-8(4-6)18(13,14)15;/h3-5H,1-2H3,(H,13,14,15);/q;+1/p-1 |
| InChI Key: | LLHSEQCZSNZLRI-UHFFFAOYSA-M |
| Purity: | > 98.0 % (T) (HPLC) |
| Density: | 1.458 g/cm3 |
| Appearance: | White to almost white powder to crystal |
| MDL: | MFCD00007493 |
| LogP: | 1.24470 |
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