AC1O585T
2,2-dimethylpropane-1,3-diol;1,3-dioxo-2-benzofuran-5-carboxylic acid;hexanedioic acid;1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione
Also Known As: (C9-H15-N3-O6.C9-H4-O5.C6-H10-O4.C5-H12-O2)x-|Neopentyl glycol, tris(hydroxyethyl)isocyanurate, trimellitic anhydride, adipic acid resin|Hexanedioic acid, polymer with 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol and 1,3,5-tris(2-hydroxyethyl)-1,3,5-triazine-2,4,6(1H,3H,5H)-trione|2,2-dimethylpropane-1,3-diol; 1,3-dioxo-2-benzofuran-5-carboxylic acid; hexanedioic acid; 1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione
| Molecular Formula | C29H41N3O17 |
|---|---|
| Molecular Weight | 703.2436 g/mol |
| LogP | -2.4428 |
| Topological Polar Surface Area | 322.42 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 14 |
| Exact Mass | 703.2436 |
| Monoisotopic Mass | 703.2436 |
| Heavy Atoms | 49 |
| Complexity | 1487.754 |
Chemical Identifiers
| CAS Number | 59518-84-2 |
|---|---|
| SMILES | CC(C)(CO)CO.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O.C(CO)N1C(=O)N(C(=O)N(C1=O)CCO)CCO |
Product Overview
AC1O585T (CAS 59518-84-2), with molecular formula C29H41N3O17 and molecular weight 703.2436 g/mol. IUPAC: 2,2-dimethylpropane-1,3-diol;1,3-dioxo-2-benzofuran-5-carboxylic acid;hexanedioic acid;1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione.