Chemical Property of Trifolin
Chemical Property:
- Vapor Pressure:1.09E-28mmHg at 25°C
- Melting Point:245-246℃
- Boiling Point:823.2°C at 760 mmHg
- PKA:6.20±0.40(Predicted)
- Flash Point:291.5°C
- PSA:190.28000
- Density:1.79±0.1 g/cm3 (20 ºC 760 Torr)
- LogP:-0.24450
- XLogP3:0.7
- Hydrogen Bond Donor Count:7
- Hydrogen Bond Acceptor Count:11
- Rotatable Bond Count:4
- Exact Mass:448.10056145
- Heavy Atom Count:32
- Complexity:719
- Purity/Quality:
-
95%-98% *data from raw suppliers
Trifolin *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
- Isomeric SMILES:C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O