1-(4-(2-Hydroxy-3-(isopropylamino)propoxy)-3-(pentyloxymethyl)phenyl)propanone maleate (2:1)

Base Information

• Chemical Name: 1-(4-(2-Hydroxy-3-(isopropylamino)propoxy)-3-(pentyloxymethyl)phenyl)propanone maleate (2:1)
• CAS No.: 106909-51-7
• Molecular Formula: C46H74N2O12
• Molecular Weight: 847.086
• Mol file: 106909-51-7.mol

Synonyms:1-(4-(2-Hydroxy-3-(isopropylamino)propoxy)-3-(pentyloxymethyl)phenyl)propanone maleate (2:1);1-Propanone, 1-(4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-3-((pentyloxy)methyl)phenyl)-, (E)-2-butenedioate (2:1) (salt);106909-51-7;C42H70N2O8.C4H4O4;LS-123050;C42-H70-N2-O8.C4-H4-O4

Chemical Property of 1-(4-(2-Hydroxy-3-(isopropylamino)propoxy)-3-(pentyloxymethyl)phenyl)propanone maleate (2:1)

Chemical Property:

• Vapor Pressure: 5.28E-11mmHg at 25°C
• Boiling Point: 504.6°Cat760mmHg
• Flash Point: 259°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 30
• Exact Mass: 846.52417580
• Heavy Atom Count: 60
• Complexity: 494

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.CCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.CCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.C(=C/C(=O)O)\C(=O)O