LU 4-003 hydrochloride
3-(1-acetyl-3,3-dimethyl-2-benzofuran-1-yl)propyl-methylazanium chloride
| Molecular Formula | C16H24ClNO2 |
|---|---|
| Molecular Weight | 297.82 g/mol |
| Topological Polar Surface Area | 42.9 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.14957 |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 22048-55-1 |
|---|---|
| SMILES | CC(=O)C1(C2=CC=CC=C2C(O1)(C)C)CCC[NH2+]C.[Cl-] |
| InChIKey | IVHJCXDXRZDAHQ-UHFFFAOYSA-N |
📖 Product Overview
LU 4-003 hydrochloride (CAS: 22048-55-1) is a chemical compound with molecular formula C16H24ClNO2 and molecular weight 297.82 g/mol. Its IUPAC systematic name is 3-(1-acetyl-3,3-dimethyl-2-benzofuran-1-yl)propyl-methylazanium chloride.
IVHJCXDXRZDAHQ-UHFFFAOYSA-N.
SMILES: CC(=O)C1(C2=CC=CC=C2C(O1)(C)C)CCC[NH2+]C.[Cl-].
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