Trimethylpentanediyl dibenzoate
(3-benzoyloxy-2,2,4-trimethylpentyl) benzoate
Also Known As: 2,2,4-Trimethylpentane-1,3-diyl dibenzoate|trimethylpentanediyl dibenzoate|2,2,4-Trimethyl-1,3-pentanediol dibenzoate|BENZOFLEX 354|EINECS 268-316-3|2,2,4-Trimethyl-1,3-pentanediol, dibenzoate|(3-benzoyloxy-2,2,4-trimethylpentyl) benzoate|1,3-Pentanediol, 2,2,4-trimethyl-, dibenzoate|Tox21_300835|NCGC00248188-01|NCGC00254739-01|CAS-68052-23-3|(+-)-TRIMETHYLPENTANEDIYL DIBENZOATE|1,3-Pentanediol, 2,2,4-trimethyl-, 1,3-dibenzoate|TRIMETHYLPENTANEDIYL DIBENZOATE [INCI]|(+/-)-TRIMETHYLPENTANEDIYL DIBENZOATE|1,3-Pentanediol,2,2,4-trimethyl-,dibenzoate|2,2,4-TRIMETHYL-1,3-PENTANEDIYL DIBENZOATE|3-(benzoyloxy)-2,2,4-trimethylpentyl benzoate|TRIMETHYLPENTANEDIYL DIBENZOATE, (+-)-|Dibenzoic acid 2,2,4-trimethyl-1,3-pentanediyl|TRIMETHYLPENTANEDIYL DIBENZOATE, (+/-)-|I01-16673|2,2,4-TRIMETHYL-1,3-PENTANEDIOL DIBENZOATE;3-pentanediol,2,2,4-trimethyl-dibenzoate;2,2,4-trimethylpentane-1,3-diyl dibenzoate;TRIMETHYLPENTANEDIYL DIBENZOATE;1,3-Pentanediol, 2,2,4-trimethyl-, dibenzoate;Dibenzoic acid 2,2,4-trimethyl-1,3-pentanediyl;1,3|268-316-3
| Molecular Formula | C22H26O4 |
|---|---|
| Molecular Weight | 354.1831 g/mol |
| LogP | 4.75 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 354.1831 |
| Heavy Atoms | 26 |
| Complexity | 720.3 |
Chemical Identifiers
| CAS Number | 68052-23-3 |
|---|---|
| SMILES | CC(C)C(C(C)(C)COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2 |
Product Overview
Trimethylpentanediyl dibenzoate (CAS 68052-23-3), with molecular formula C22H26O4 and molecular weight 354.1831 g/mol. IUPAC: (3-benzoyloxy-2,2,4-trimethylpentyl) benzoate.
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