Chemical Property of 8-O-Acetylharpagide
Chemical Property:
- Vapor Pressure:1.96E-15mmHg at 25°C
- Melting Point:227-229℃
- Boiling Point:571.4°C at 760 mmHg
- PKA:11.88±0.70(Predicted)
- Flash Point:201.8°C
- PSA：175.37000
- Density:1.58
- LogP:-2.89340
- Storage Temp.:?20°C
- XLogP3:-2.7
- Hydrogen Bond Donor Count:6
- Hydrogen Bond Acceptor Count:11
- Rotatable Bond Count:5
- Exact Mass:406.14751164
- Heavy Atom Count:28
- Complexity:626
- Purity/Quality:
-
≥98% *data from raw suppliers
3-Acetylharpagide *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- Safety Statements:
24/25
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC(=O)OC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O)C
- Isomeric SMILES:CC(=O)O[C@]1(C[C@H]([C@]2([C@@H]1[C@@H](OC=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)C
-
Uses
3-Acetylharpagide is an iridoid glycoside displaying antibacterial, antiinflammatory and antiviral effects.
