Chemical Property of 7-Caffeoylloganin
Chemical Property:
- Vapor Pressure:2.56E-25mmHg at 25°C
- Boiling Point:775.6°Cat760mmHg
- Flash Point:257.4°C
- PSA:201.67000
- Density:1.53g/cm3
- LogP:-0.47530
- XLogP3:0.6
- Hydrogen Bond Donor Count:6
- Hydrogen Bond Acceptor Count:13
- Rotatable Bond Count:9
- Exact Mass:552.18429107
- Heavy Atom Count:39
- Complexity:937
- Purity/Quality:
-
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C=CC4=CC(=C(C=C4)O)O
- Isomeric SMILES:C[C@@H]1[C@@H](C[C@@H]2[C@H]1[C@H](OC=C2C(=O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)OC(=O)/C=C/C4=CC(=C(C=C4)O)O