Chemical Property of Neocomplanoside
Chemical Property:
- Vapor Pressure:9.2E-27mmHg at 25°C
- Boiling Point:796.6°Cat760mmHg
- Flash Point:273.1°C
- PSA：185.35000
- Density:1.61g/cm3
- LogP:0.62930
- XLogP3:1.1
- Hydrogen Bond Donor Count:5
- Hydrogen Bond Acceptor Count:12
- Rotatable Bond Count:7
- Exact Mass:504.12677620
- Heavy Atom Count:36
- Complexity:837
- 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:CC(=O)OCC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)OC)C4=CC=C(C=C4)O)O)O)O
- Isomeric SMILES:CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)OC)C4=CC=C(C=C4)O)O)O)O
