AC1O5BUP
benzene-1,3-dicarboxylic acid;ethane-1,2-diol;1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione
Also Known As: (C9-H15-N3-O6.C8-H6-O4.C2-H6-O2)x-|1,3-Benzenedicarboxylic acid, polymer with 1,2-ethanediol and 1,3,5-tris(2-hydroxyethyl)-1,3,5-triazine-2,4,6(1H,3H,5H)-trione|1,3,5-Tris(2-hydroxyethyl)-1,3,5-triazine-2,4,6(1H,3H,5H)-trione, ethylene glycol, isophthalate polymer|benzene-1,3-dicarboxylic acid; ethane-1,2-diol; 1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione
| Molecular Formula | C19H27N3O12 |
|---|---|
| Molecular Weight | 489.1595 g/mol |
| LogP | -3.7974 |
| Topological Polar Surface Area | 241.75 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 489.1595 |
| Monoisotopic Mass | 489.1595 |
| Heavy Atoms | 34 |
| Complexity | 960.4047 |
Chemical Identifiers
| CAS Number | 67906-79-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CO)N1C(=O)N(C(=O)N(C1=O)CCO)CCO.C(CO)O |
Product Overview
AC1O5BUP (CAS 67906-79-0), with molecular formula C19H27N3O12 and molecular weight 489.1595 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;ethane-1,2-diol;1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione.
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