Chemical Property of CID 122852
Chemical Property:
- Vapor Pressure:1.86E-15mmHg at 25°C
- Melting Point:335℃
- Boiling Point:571.8°C at 760 mmHg
- PKA:4.79±0.70(Predicted)
- Flash Point:178.9°C
- PSA:66.76000
- Density:1.15g/cm3
- LogP:6.65150
- XLogP3:7.2
- Hydrogen Bond Donor Count:2
- Hydrogen Bond Acceptor Count:4
- Rotatable Bond Count:1
- Exact Mass:472.35526001
- Heavy Atom Count:34
- Complexity:918
- Purity/Quality:
-
99% *data from raw suppliers
Salaspermicacid 95+% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1C23CCC4C(C2CCC1(OC3)O)(CCC5(C4(CCC6(C5CC(CC6)(C)C(=O)O)C)C)C)C
- Isomeric SMILES:C[C@@H]1C23CCC4[C@](C2CCC1(OC3)O)(CC[C@@]5([C@@]4(CC[C@@]6(C5C[C@](CC6)(C)C(=O)O)C)C)C)C