Roseofungin

Base Information

• Chemical Name: Roseofungin
• CAS No.: 12687-98-8
• Molecular Formula: C39H62 O10
• Molecular Weight: 690.9
• Mol file: 12687-98-8.mol

Synonyms:roseofungin

Chemical Property of Roseofungin

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 916°C at 760 mmHg
• PKA: 14.03±0.70(Predicted)
• Flash Point: 273.5°C
• PSA: 181.82000
• Density: 1.083g/cm³
• LogP: 4.89400
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 1
• Exact Mass: 690.43429817
• Heavy Atom Count: 49
• Complexity: 1110

Purity/Quality:

99%, ^*data from raw suppliers

ROSEOFUNGIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=CC=CC=CCC(CC(CC(CC(CC(=O)CC(CC(CC(=O)CCCCCCCC(OC1=O)C(C)C)O)O)O)O)O)O
• Isomeric SMILES: C/C/1=C\C=C\C=C\C=C\C=C\CC(CC(CC(CC(CC(=O)CC(CC(CC(=O)CCCCCCCC(OC1=O)C(C)C)O)O)O)O)O)O