Chemical Property of CID 5489185
Chemical Property:
- Vapor Pressure:7.55E-18mmHg at 25°C
- Boiling Point:651.2°C at 760 mmHg
- Flash Point:347.7°C
- PSA:119.69000
- Density:1.29g/cm3
- LogP:1.38590
- XLogP3:-0.5
- Hydrogen Bond Donor Count:4
- Hydrogen Bond Acceptor Count:8
- Rotatable Bond Count:5
- Exact Mass:461.24135246
- Heavy Atom Count:33
- Complexity:755
- 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:CC1C2CC3=C(C1(CCN2CC=C(C)C)C)C=C(C=C3)OC4C(C(C(C(O4)C(=O)O)O)O)O
- Isomeric SMILES:C[C@@H]1C2CC3=C([C@@]1(CCN2CC=C(C)C)C)C=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O