Isopropyl hydrogen adipate
6-oxo-6-propan-2-yloxyhexanoic acid
Also Known As: Isopropyl hydrogen adipate|isopropylhydrogenadipate|6-isopropoxy-6-oxohexanoic acid|6-oxo-6-propan-2-yloxyhexanoic acid|EINECS 257-751-4|Hexanedioic acid 1-isopropyl ester|AI3-06610|6-oxo-6-(propan-2-yloxy)hexanoic acid|Hexanedioic acid,1-(1-methylethyl) ester|6-Oxo-6-[(propan-2-yl)oxy]hexanoic acid|Hexanedioic acid hydrogen 1-isopropyl ester|Hexanedioic acid, mono(1-methylethyl) ester
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10486 g/mol |
| LogP | 1.58 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 174.5 |
Chemical Identifiers
| CAS Number | 52221-06-4 |
|---|---|
| SMILES | CC(C)OC(=O)CCCCC(=O)O |
Product Overview
Isopropyl hydrogen adipate (CAS 52221-06-4), with molecular formula C9H16O4 and molecular weight 188.10486 g/mol. IUPAC: 6-oxo-6-propan-2-yloxyhexanoic acid.
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