Chemical Property of Brianthein V
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Chemical Property:
- Vapor Pressure:2.46E-19mmHg at 25°C
- Boiling Point:644.6°Cat760mmHg
- Flash Point:343.6°C
- Density:1.28g/cm3
- XLogP3:3.6
- Hydrogen Bond Donor Count:1
- Hydrogen Bond Acceptor Count:10
- Rotatable Bond Count:10
- Exact Mass:596.2388252
- Heavy Atom Count:41
- Complexity:1120
- Purity/Quality:
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Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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SDS file from LookChem
Useful:
- Canonical SMILES:CCCC(=O)OC1C=CC(=C)C(C2C(C(C(=O)O2)C)(C(C3C1(C4C(O4)C(C3C)OC(=O)CCC)C)OC(=O)C)O)Cl
- Isomeric SMILES:CCCC(=O)OC1/C=C/C(=C)C(C2C(C(C(=O)O2)C)(C(C3C1(C4C(O4)C(C3C)OC(=O)CCC)C)OC(=O)C)O)Cl