1,2-Benzenedicarboxylic acid, 1-(1-ethylhexyl) ester
2-octan-3-yloxycarbonylbenzoic acid
Also Known As: hydrogenphthalate|Mono(1-ethylhexyl) phthalate|(1-Ethylhexyl) hydrogen phthalate|EINECS 245-547-8|2-octan-3-yloxycarbonylbenzoic acid|2-[(octan-3-yloxy)carbonyl]benzoic acid|Phthalic acid, mono(1-ethylhexyl) ester|2-{[(Octan-3-yl)oxy]carbonyl}benzoic acid|Phthalic acid hydrogen 1-(1-ethylhexyl) ester|1,2-Benzenedicarboxylic acid, mono(1-ethylhexyl) ester|1,2-benzenedicarboxylic acid mono(ethylhexyl) ester|1,2-Benzenedicarboxylic acid, 1-(1-ethylhexyl) ester|1,2-Benzenedicarboxylicacid, 1-(1-ethylhexyl) ester|245-547-8
| Molecular Formula | C16H22O4 |
|---|---|
| Molecular Weight | 278.1518 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.1518 |
| Heavy Atoms | 20 |
| Complexity | 453.5 |
Chemical Identifiers
| CAS Number | 23276-77-9 |
|---|---|
| SMILES | CCCCCC(CC)OC(=O)C1=CC=CC=C1C(=O)O |
Product Overview
1,2-Benzenedicarboxylic acid, 1-(1-ethylhexyl) ester (CAS 23276-77-9), with molecular formula C16H22O4 and molecular weight 278.1518 g/mol. IUPAC: 2-octan-3-yloxycarbonylbenzoic acid.
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