2,4,6-Cycloheptatriene-1-acetic acid, 3-morpholinopropyl ester, hydrochloride
3-morpholin-4-ium-4-ylpropyl 2-cyclohepta-2,4,6-trien-1-ylacetate chloride
Also Known As: MP 45|RefChem:1059616|AC1L191H|2,4,6-CYCLOHEPTATRIENE-1-ACETIC ACID, 3-MORPHOLINOPROPYL ESTER, HYDROCHLORIDE|2,4,6-Cycloheptatriene-1-acetic acid, 3-(4-morpholinyl)propyl ester, hydrochloride|3-morpholin-4-ium-4-ylpropyl 2-cyclohepta-2,4,6-trien-1-ylacetate chloride
| Molecular Formula | C16H24ClNO3 |
|---|---|
| Molecular Weight | 313.14447 g/mol |
| LogP | -2.47 |
| Topological Polar Surface Area | 39.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.14447 |
| Heavy Atoms | 21 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 69352-80-3 |
|---|---|
| SMILES | C1COCC[NH+]1CCCOC(=O)CC2C=CC=CC=C2.[Cl-] |
Product Overview
2,4,6-Cycloheptatriene-1-acetic acid, 3-morpholinopropyl ester, hydrochloride (CAS 69352-80-3), with molecular formula C16H24ClNO3 and molecular weight 313.14447 g/mol. IUPAC: 3-morpholin-4-ium-4-ylpropyl 2-cyclohepta-2,4,6-trien-1-ylacetate chloride.
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