Itanoxone
4-[4-(2-chlorophenyl)phenyl]-2-methylidene-4-oxobutanoic acid
| Molecular Formula | C17H13ClO3 |
|---|---|
| Molecular Weight | 300.7 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 54.4 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.05533 |
| Heavy Atoms | 21 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 58182-63-1 |
|---|---|
| SMILES | C=C(CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2Cl)C(=O)O |
| InChIKey | HJWLWNLAIBFKDO-UHFFFAOYSA-N |
📖 Product Overview
Itanoxone (CAS: 58182-63-1) is a chemical compound with molecular formula C17H13ClO3 and molecular weight 300.7 g/mol. Its IUPAC systematic name is 4-[4-(2-chlorophenyl)phenyl]-2-methylidene-4-oxobutanoic acid.
HJWLWNLAIBFKDO-UHFFFAOYSA-N.
SMILES: C=C(CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2Cl)C(=O)O.
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