Chemical Property of Deoxyisocalyciphylline B
Chemical Property:
- Melting Point:182 °C (decomp)
- Boiling Point:502.3±50.0 °C(Predicted)
- PKA:9.03±0.60(Predicted)
- PSA：29.54000
- Density:1.20±0.1 g/cm3(Predicted)
- LogP:3.86530
- XLogP3:3.5
- Hydrogen Bond Donor Count:0
- Hydrogen Bond Acceptor Count:3
- Rotatable Bond Count:0
- Exact Mass:341.235479232
- Heavy Atom Count:25
- Complexity:671
- Purity/Quality:
-
97.00% *data from raw suppliers
DeoxycalyciphyllineB 95+% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1CN2C3C(CCC4C3=CCC4)C5(C6(C2C1CC6)CCC(=O)O5)C
- Isomeric SMILES:C[C@@H]1CN2[C@@H]3[C@H](CC[C@@H]4C3=CCC4)[C@]5([C@]6([C@@H]2[C@@H]1CC6)CCC(=O)O5)C
