4-Hydroxyhernandulcin

Base Information

• Chemical Name: 4-Hydroxyhernandulcin
• CAS No.: 145385-64-4
• Molecular Formula: C15H24 O3
• Molecular Weight: 252.35
• DSSTox Substance ID: DTXSID40162999
• Mol file: 145385-64-4.mol

Synonyms:4-hydroxyhernandulcin

Chemical Property of 4-Hydroxyhernandulcin

Chemical Property:

• Vapor Pressure: 1.01E-08mmHg at 25°C
• Boiling Point: 417.6°Cat760mmHg
• PKA: 13.54±0.60(Predicted)
• Flash Point: 220.5°C
• PSA: 57.53000
• Density: 1.076g/cm³
• LogP: 2.38000
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 252.17254462
• Heavy Atom Count: 18
• Complexity: 377

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=O)C(CC1O)C(C)(CCC=C(C)C)O
• Isomeric SMILES: CC1=CC(=O)[C@@H](C[C@H]1O)[C@](C)(CCC=C(C)C)O