4-Hydroxyetretinate

Base Information

• Chemical Name: 4-Hydroxyetretinate
• CAS No.: 66757-07-1
• Molecular Formula: C22H28O3
• Molecular Weight: 340.46
• Nikkaji Number: J549.953D
• Mol file: 66757-07-1.mol

Synonyms:4-hydroxyetretinate;Ro 11-4768;Ro-11-4768

Chemical Property of 4-Hydroxyetretinate

Chemical Property:

• Vapor Pressure: 1.55E-10mmHg at 25°C
• Boiling Point: 497.9°C at 760 mmHg
• Flash Point: 196.6°C
• PSA: 46.53000
• Density: 1.042g/cm³
• LogP: 5.34250
• XLogP3: 6.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 340.20384475
• Heavy Atom Count: 25
• Complexity: 554

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C=C(C)C=CC=C(C)C=CC1=C(C(=C(C=C1C)O)C)C
• Isomeric SMILES: CCOC(=O)/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C(=C(C=C1C)O)C)C