CCRIS 8271
2,2-bis(hydroxymethyl)propane-1,3-diol;hexanedioic acid;octadecanoic acid
Also Known As: pentaerythritol adipate stearate|Adipic acid, pentaerythritol polymer, stearate|Hexanedioic acid, polymer with 2,2-bis(hydroxymethyl)-1,3-propanediol, octadecanoate|ADIPIC ACID, POLYPENTAERYTHRITOL, STEARATE|C18-H36-O2.x-(C6H10-O4.C5-H12-O4)x-|adipic acid; 2,2-bis(hydroxymethyl)propane-1,3-diol; stearic acid|POLY(ADIPIC ACID-CO-PENTAERYTHRITOL-CO-STEARIC ACID)|2,2-bis(hydroxymethyl)propane-1,3-diol;hexanedioic acid;octadecanoic acid|2,2-bis(hydroxymethyl)propane-1,3-diol; hexanedioic acid; octadecanoic acid|601-364-9|614-290-7
| Molecular Formula | C29H58O10 |
|---|---|
| Molecular Weight | 566.403 g/mol |
| LogP | 4.9905 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 25 |
| Exact Mass | 566.403 |
| Monoisotopic Mass | 566.403 |
| Heavy Atoms | 39 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 79173-15-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)O.C(CCC(=O)O)CC(=O)O.C(C(CO)(CO)CO)O |
| InChIKey | ZIUHCEIEPOPBCK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CCRIS 8271 (CAS 79173-15-2), with molecular formula C29H58O10 and molecular weight 566.403 g/mol. IUPAC: 2,2-bis(hydroxymethyl)propane-1,3-diol;hexanedioic acid;octadecanoic acid.
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