Oxazole, 5-methyl-4-phenyl-, 1,2-ethanedisulfonate (2:1)
ethane-1,2-disulfonic acid;bis(5-methyl-4-phenyl-1,3-oxazole)
Also Known As: C10H9NO.1/2C2H6O6S2|5-Methyl-4-phenyloxazole 1,2-ethanedisulfonate (2:1)|Oxazole, 5-methyl-4-phenyl-, 1,2-ethanedisulfonate (2:1)|C10-H9-N-O.1/2C2-H6-O6-S2|1,2-Ethane disulfonic acid, compd. with 5-methyl-4-phenyloxazole (1:2)|ethane-1,2-disulfonic acid- 5-methyl-4-phenyl-1,3-oxazole(1:2)|O-(2-Chloro-4-fluorobenzyl)hydroxylamine hydrochloride|ethane-1,2-disulfonic acid,5-methyl-4-phenyl-1,3-oxazole|ethane-1,2-disulfonic acid; 5-methyl-4-phenyl-1,3-oxazole|Ethane-1,2-disulfonic acid--5-methyl-4-phenyl-1,3-oxazole (1/2)
| Molecular Formula | C22H24N2O8S2 |
|---|---|
| Molecular Weight | 508.0974 g/mol |
| LogP | 4.06204 |
| Topological Polar Surface Area | 178.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 508.0974 |
| Monoisotopic Mass | 508.0974 |
| Heavy Atoms | 34 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 36775-20-9 |
|---|---|
| SMILES | CC1=C(N=CO1)C2=CC=CC=C2.CC1=C(N=CO1)C2=CC=CC=C2.C(CS(=O)(=O)O)S(=O)(=O)O |
| InChIKey | UVLCHFGYCQRMRX-UHFFFAOYSA-N |
Product Overview
Oxazole, 5-methyl-4-phenyl-, 1,2-ethanedisulfonate (2:1) (CAS 36775-20-9), with molecular formula C22H24N2O8S2 and molecular weight 508.0974 g/mol. IUPAC: ethane-1,2-disulfonic acid;bis(5-methyl-4-phenyl-1,3-oxazole).