Treprostinil Impurity 19
2-[[(1S,2S,3aR,9aR)-2-hydroxy-1-[(3R)-3-hydroxyoctyl]-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[g]naphthalen-5-yl]oxy]acetic acid
| Molecular Formula | C23H34O5 |
|---|---|
| Molecular Weight | 390.5 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 87.0 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 390.24063 |
| Heavy Atoms | 28 |
| Complexity | 495.0 |
Chemical Identifiers
| CAS Number | 112421-28-0 |
|---|---|
| SMILES | CCCCCC(CCC1C(CC2C1CC3=C(C2)C(=CC=C3)OCC(=O)O)O)O |
| InChIKey | PAJMKGZZBBTTOY-YRIDSSQKSA-N |
📖 Product Overview
Treprostinil Impurity 19 (CAS: 112421-28-0) is a chemical compound with molecular formula C23H34O5 and molecular weight 390.5 g/mol. Its IUPAC systematic name is 2-[[(1S,2S,3aR,9aR)-2-hydroxy-1-[(3R)-3-hydroxyoctyl]-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[g]naphthalen-5-yl]oxy]acetic acid.
PAJMKGZZBBTTOY-YRIDSSQKSA-N.
SMILES: CCCCCC(CCC1C(CC2C1CC3=C(C2)C(=CC=C3)OCC(=O)O)O)O.
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