Pentaerythritol, dibenzoate
[2-(benzoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] benzoate
Also Known As: Pentaerythrite dibenzoate|Pentaerythritol, dibenzoate|Dwubenzoesan pentaery trytu|Pentaerythritol dibenzoate|Dwubenzoesan pentaery trytu [Polish]|3-09-00-00688 (Beilstein Handbook Reference)|2,2-Bis(hydroxymethyl)propane-1,3-diyl dibenzoate|2,2-bis(benzoyloxymethyl)-1,3-propanediol|2,2-Bis(phenylcarboxymethyl)propane-1,3-diol|J1.525.237E|2,2-dihydroxymethyl-1,3-propandiol dibenzoate|1,3-Propanediol, 2-((benzoyloxy)methyl)-2-(hydroxymethyl)-, 1-benzoate|A1-130408|Dibenzoic acid 2,2-bis(hydroxymethyl)trimethylene ester|[2-(benzoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] benzoate|1,3-Propanediol, 2-[(benzoyloxy)methyl]-2-(hydroxymethyl)-, 1-benzoate|2-[(BENZOYLOXY)METHYL]-3-HYDROXY-2-(HYDROXYMETHYL)PROPYL BENZOATE
| Molecular Formula | C19H20O6 |
|---|---|
| Molecular Weight | 344.12598 g/mol |
| LogP | 1.6714 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 344.12598 |
| Monoisotopic Mass | 344.12598 |
| Heavy Atoms | 25 |
| Complexity | 622.0752 |
Chemical Identifiers
| CAS Number | 76597-90-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OCC(CO)(CO)COC(=O)C2=CC=CC=C2 |
Product Overview
Pentaerythritol, dibenzoate (CAS 76597-90-5), with molecular formula C19H20O6 and molecular weight 344.12598 g/mol. IUPAC: [2-(benzoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] benzoate.
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