2,7-Bis((hexahydro-1H-azepin-1-yl)methyl)-1,8-bis(4-methoxyphenyl)-1,8-octanedione 2HCl

Base Information

• Chemical Name: 2,7-Bis((hexahydro-1H-azepin-1-yl)methyl)-1,8-bis(4-methoxyphenyl)-1,8-octanedione 2HCl
• CAS No.: 120698-34-2
• Molecular Formula: C36H52 N2 O4 . 2 Cl H
• Molecular Weight: 649.731
• DSSTox Substance ID: DTXSID90923532

Synonyms:2,7-Bis((hexahydro-1H-azepin-1-yl)methyl)-1,8-bis(4-methoxyphenyl)-1,8-octanedione 2HCl;120698-34-2;1,8-Octanedione, 2,7-bis((hexahydro-1H-azepin-1-yl)methyl)-1,8-bis(4-methoxyphenyl)-, dihydrochloride;2,7-bis(azepan-1-ylmethyl)-1,8-bis(4-methoxyphenyl)octane-1,8-dione;dihydrochloride;C36H52N2O4.2ClH;DTXSID90923532;AKOS032424839;LS-97905;2,7-Bis[(azepan-1-yl)methyl]-1,8-bis(4-methoxyphenyl)octane-1,8-dione--hydrogen chloride (1/2)

Chemical Property of 2,7-Bis((hexahydro-1H-azepin-1-yl)methyl)-1,8-bis(4-methoxyphenyl)-1,8-octanedione 2HCl

Chemical Property:

• Vapor Pressure: 1.94E-19mmHg at 25°C
• Boiling Point: 699.9°Cat760mmHg
• Flash Point: 377.1°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 15
• Exact Mass: 648.3460636
• Heavy Atom Count: 44
• Complexity: 694

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(=O)C(CCCCC(CN2CCCCCC2)C(=O)C3=CC=C(C=C3)OC)CN4CCCCCC4.Cl.Cl

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