2,2-Bis(hydroxymethyl)propane-1,3-diyl diacetate
[2-(acetyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] acetate
Also Known As: pentaerythritol diacetate|2,2-bis(hydroxymethyl)propane-1,3-diyl diacetate|Ethanone,1-[2-(acetyloxy)phenyl]-|2,2-Bis(acetoxymethyl)-1,3-propanediol|2,2-Bis(hydroxymethyl)-1,3-propanediyl diacetate|[2-(acetyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] acetate|2-[(ACETYLOXY)METHYL]-3-HYDROXY-2-(HYDROXYMETHYL)PROPYL ACETATE
| Molecular Formula | C9H16O6 |
|---|---|
| Molecular Weight | 220.09468 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 220.09468 |
| Monoisotopic Mass | 220.09468 |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 936-75-4 |
|---|---|
| SMILES | CC(=O)OCC(CO)(CO)COC(=O)C |
| InChIKey | SMWVKLFSRAUNLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Bis(hydroxymethyl)propane-1,3-diyl diacetate (CAS 936-75-4), with molecular formula C9H16O6 and molecular weight 220.09468 g/mol. IUPAC: [2-(acetyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] acetate.
2,2-Bis(hydroxymethyl)propane-1,3-diyl diacetate is a custom synthesis product. We offer services from milligram to kilogram scale.
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