AC1L41ZE
benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;1,3-dioxo-2-benzofuran-5-carboxylic acid;tridecane
Also Known As: C13-H28-O.x-(C9H4-O5.C8-H6-O4.C5-H12-O2)x-|1,3-Benzenedicarboxylic acid, polymer with 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid and 2,2-dimethyl-1,3-propanediol, tridecyl ester|benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 1,3-dioxo-2-benzofuran-5-carboxylic acid; tridecane
CAS: 68070-96-2
| Molecular Formula | C35H50O11 |
|---|---|
| Molecular Weight | 646.3353 g/mol |
| LogP | 7.0929 |
| Topological Polar Surface Area | 196.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 15 |
| Exact Mass | 646.3353 |
| Monoisotopic Mass | 646.3353 |
| Heavy Atoms | 46 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 68070-96-2 |
|---|---|
| SMILES | CCCCCCCCCCCCC.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O |
| InChIKey | AHZGLGPYCAOXTN-UHFFFAOYSA-N |
Product Overview
AC1L41ZE (CAS 68070-96-2), with molecular formula C35H50O11 and molecular weight 646.3353 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;1,3-dioxo-2-benzofuran-5-carboxylic acid;tridecane.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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