Chemical Property of Bruceajavanin A
Chemical Property:
- Vapor Pressure:4.93E-15mmHg at 25°C
- Boiling Point:614.5°Cat760mmHg
- Flash Point:253.7°C
- PSA:91.43000
- Density:1.18g/cm3
- LogP:5.95000
- XLogP3:5.8
- Hydrogen Bond Donor Count:0
- Hydrogen Bond Acceptor Count:7
- Rotatable Bond Count:6
- Exact Mass:568.34000387
- Heavy Atom Count:41
- Complexity:1230
- Purity/Quality:
-
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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SDS file from LookChem
Useful:
- Canonical SMILES:CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C4=CCC(C4(CC3)C)C5CC(OC5OC(=O)C)C6C(O6)(C)C)C)C)(C)C
- Isomeric SMILES:CC(=O)O[C@@H]1C[C@@H]2[C@](C=CC(=O)C2(C)C)([C@@H]3[C@@]1(C4=CC[C@H]([C@@]4(CC3)C)[C@@H]5C[C@@H](O[C@@H]5OC(=O)C)[C@H]6C(O6)(C)C)C)C