Chemical Property of B-acetyldigitoxin
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Refractive Index:1.6130 (estimate)
- Boiling Point:902.2°Cat760mmHg
- Flash Point:265°C
- PSA：188.90000
- Density:1.31g/cm3
- LogP:3.81810
- XLogP3:2.8
- Hydrogen Bond Donor Count:4
- Hydrogen Bond Acceptor Count:14
- Rotatable Bond Count:9
- Exact Mass:806.44525677
- Heavy Atom Count:57
- Complexity:1520
- Purity/Quality:
-
99% *data from raw suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)O)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)OC(=O)C)O)O
- Isomeric SMILES:C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)OC(=O)C)O)O
