Chemical Property of Isotaxiresinol
Chemical Property:
- Melting Point:171 °C
- Boiling Point:607.6±55.0 °C(Predicted)
- PKA:9.72±0.10(Predicted)
- PSA：110.38000
- Density:1.348±0.06 g/cm3(Predicted)
- LogP:1.71700
- XLogP3:1.7
- Hydrogen Bond Donor Count:5
- Hydrogen Bond Acceptor Count:6
- Rotatable Bond Count:4
- Exact Mass:346.14163842
- Heavy Atom Count:25
- Complexity:432
- Purity/Quality:
-
98% *data from raw suppliers
Isotaxiresinol 95+% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:COC1=C(C=C2C(C(C(CC2=C1)CO)CO)C3=CC(=C(C=C3)O)O)O
- Isomeric SMILES:COC1=C(C=C2[C@@H]([C@H]([C@@H](CC2=C1)CO)CO)C3=CC(=C(C=C3)O)O)O
