AC1Q1UXU
disodium;formaldehyde;2-hydroxy-5-[2-(4-hydroxy-3-sulfonatophenyl)propan-2-yl]benzenesulfonate;4-(4-hydroxyphenyl)sulfonylphenol
Also Known As: (C15-H16-O8-S2.C12-H10-O4-S.C-H2-O.2Na)x-|Benzenesulfonic acid, 3,3'-(1-methylethylidene)bis(6-hydroxy-, disodium salt, polymer with formaldehyde and 4,4'-sulfonylbis(phenol)|Benzenesulfonic acid, 3,3'-(1-methylethylidene)bis(6-hydroxy-, sodium salt (1:2), polymer with formaldehyde and 4,4'-sulfonylbis(phenol)|Benzenesulfonic acid, 3,3'-(1-methylethylidene)bis[6-hydroxy-, disodium salt, polymer with formaldehyde and 4,4'-sulfonylbis[phenol]|disodium; formaldehyde; 2-hydroxy-5-[2-(4-hydroxy-3-sulfonatophenyl)propan-2-yl]benzenesulfonate; 4-(4-hydroxyphenyl)sulfonylphenol
| Molecular Formula | C28H26Na2O13S3 |
|---|---|
| Molecular Weight | 712.0331 g/mol |
| LogP | -3.0144 |
| Topological Polar Surface Area | 272.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 712.0331 |
| Monoisotopic Mass | 712.0331 |
| Heavy Atoms | 46 |
| Complexity | 893.0 |
Chemical Identifiers
| CAS Number | 75701-47-2 |
|---|---|
| SMILES | CC(C)(C1=CC(=C(C=C1)O)S(=O)(=O)[O-])C2=CC(=C(C=C2)O)S(=O)(=O)[O-].C=O.C1=CC(=CC=C1O)S(=O)(=O)C2=CC=C(C=C2)O.[Na+].[Na+] |
| InChIKey | JKMKTCGSNNTGLV-UHFFFAOYSA-L |
Product Overview
AC1Q1UXU (CAS 75701-47-2), with molecular formula C28H26Na2O13S3 and molecular weight 712.0331 g/mol. IUPAC: disodium;formaldehyde;2-hydroxy-5-[2-(4-hydroxy-3-sulfonatophenyl)propan-2-yl]benzenesulfonate;4-(4-hydroxyphenyl)sulfonylphenol.