AC1L57Y7
benzene-1,3-dicarboxylic acid;2-benzofuran-1,3-dione;2,2-dimethylpropane-1,3-diol;1,3-dioxo-2-benzofuran-5-carboxylic acid;hexanedioic acid
Also Known As: (C9-H4-O5.C8-H6-O4.C8-H4-O3.C6-H10-O4.C5-H12-O2)x-|Adipic acid, phthalic anhydride, isophthalic acid, trimellitic anhydride, neopentyl glycol polymer|1,3-Benzenedicarboxylic acid, polymer with 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,3-isobenzofurandione|benzene-1,3-dicarboxylic acid; 2-benzofuran-1,3-dione; 2,2-dimethylpropane-1,3-diol; 1,3-dioxo-2-benzofuran-5-carboxylic acid; hexanedioic acid
| Molecular Formula | C36H36O18 |
|---|---|
| Molecular Weight | 756.1902 g/mol |
| LogP | 3.4888 |
| Topological Polar Surface Area | 314.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 756.1902 |
| Monoisotopic Mass | 756.1902 |
| Heavy Atoms | 54 |
| Complexity | 833.0 |
Chemical Identifiers
| CAS Number | 65622-99-3 |
|---|---|
| SMILES | CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O |
| InChIKey | ILPDWSOLBZQTGM-UHFFFAOYSA-N |
Product Overview
AC1L57Y7 (CAS 65622-99-3), with molecular formula C36H36O18 and molecular weight 756.1902 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2-benzofuran-1,3-dione;2,2-dimethylpropane-1,3-diol;1,3-dioxo-2-benzofuran-5-carboxylic acid;hexanedioic acid.