AC1L58HF
benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexane-1,6-diol
Also Known As: (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-|1,3-Benzenedicarboxylic acid, trimethylolpropane, neopentyl glycol,1,6-hexanediol polymer|1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol and 1,6-hexanediol|1,3-Benzenedicarboxylic acid, trimethylolpropane, neopentyl glycol, 1,6-hexanediol polymer|benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diol
| Molecular Formula | C25H46O11 |
|---|---|
| Molecular Weight | 522.304 g/mol |
| LogP | 0.9713 |
| Topological Polar Surface Area | 216.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 522.304 |
| Monoisotopic Mass | 522.304 |
| Heavy Atoms | 36 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 67892-80-2 |
|---|---|
| SMILES | CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO |
| InChIKey | UYGZYRAORIEMME-UHFFFAOYSA-N |
Product Overview
AC1L58HF (CAS 67892-80-2), with molecular formula C25H46O11 and molecular weight 522.304 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexane-1,6-diol.