Phthalic acid mono-sec-butyl ester
2-butan-2-yloxycarbonylbenzoic acid
Also Known As: Mono-sec-butyl phthalate|MONOSEC-BUTYLPHTHALATE|2-butan-2-yloxycarbonylbenzoic acid|Phthalic acid, mono-sec-butyl ester|2-(sec-Butoxycarbonyl)benzoic acid|Phthalsauremethyl-n-Propylester|2-butan-2-yloxycarbonylbenzoate|Phthalsaeure-mono-sec-butylester|2-sec-butoxycarbonylbenzoic acid|2-[(butan-2-yloxy)carbonyl]benzoic acid|AI3-11180|PHTHALIC ACID MONO-SEC-BUTYL ESTER|Phthalic acid hydrogen 1-sec-butyl ester|1,2-Benzenedicarboxylic acid, mono(1-methylpropyl) ester|1,2-Benzenedicarboxylic acid, 1-(1-methylpropyl) ester|1,2-Benzenedicarboxylic Acid 1-(1-methylpropyl) Ester|1,2-Benzenedicarboxylic Acid 1-(1-methylpropyl) Ester; 1,2-Benzenedicarboxylic Acid Mono(1-methylpropyl) Ester; Phthalic Acid sec-Butyl Ester; NSC 29059;|684-532-4
| Molecular Formula | C12H14O4 |
|---|---|
| Molecular Weight | 222.0892 g/mol |
| LogP | 2.34 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.0892 |
| Heavy Atoms | 16 |
| Complexity | 397.8 |
Chemical Identifiers
| CAS Number | 53623-59-9 |
|---|---|
| SMILES | CCC(C)OC(=O)C1=CC=CC=C1C(=O)O |
Product Overview
Phthalic acid mono-sec-butyl ester (CAS 53623-59-9), with molecular formula C12H14O4 and molecular weight 222.0892 g/mol. IUPAC: 2-butan-2-yloxycarbonylbenzoic acid.
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