Chemical Property of (+)-Xanthochymol
Chemical Property:
- Vapor Pressure:2.63E-21mmHg at 25°C
- Boiling Point:712.5°C at 760 mmHg
- PKA:4.50±1.00(Predicted)
- Flash Point:398.7°C
- PSA:111.90000
- Density:1.107g/cm3
- LogP:8.91460
- XLogP3:10.6
- Hydrogen Bond Donor Count:3
- Hydrogen Bond Acceptor Count:6
- Rotatable Bond Count:11
- Exact Mass:602.36073931
- Heavy Atom Count:44
- Complexity:1290
- Purity/Quality:
-
95% *data from raw suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC(=CCC1CC2(C(=O)C(=C(C3=CC(=C(C=C3)O)O)O)C(=O)C(C2=O)(C1(C)C)CC=C(C)C)CC(CCC(=C)C)C(=C)C)C
- Isomeric SMILES:CC(=CC[C@H]1C[C@]2(C(=O)/C(=C(/C3=CC(=C(C=C3)O)O)\O)/C(=O)[C@](C2=O)(C1(C)C)CC=C(C)C)C[C@@H](CCC(=C)C)C(=C)C)C