4-(2-(N,N-Diphenethylamino)ethyl)pyrocatechol oxalate (2:1)

Base Information

• Chemical Name: 4-(2-(N,N-Diphenethylamino)ethyl)pyrocatechol oxalate (2:1)
• CAS No.: 70045-18-0
• Molecular Formula: C50H56N2O8
• Molecular Weight: 812.9882
• DSSTox Substance ID: DTXSID90990289

Synonyms:4-(2-(N,N-Diphenethylamino)ethyl)pyrocatechol oxalate (2:1);70045-18-0;Pyrocatechol, 4-(2-(N,N-diphenethylamino)ethyl)-, oxalate (2:1);C48H54N2O4.C2H4O4;C48-H54-N2-O4.C2-H4-O4;1,2-Benzenediol, 4-[2-[bis(2-phenylethyl)amino]ethyl]-, ethanedioate (2:1) (salt);DTXSID90990289;LS-136430;Oxalic acid--4-{2-[bis(2-phenylethyl)amino]ethyl}benzene-1,2-diol (1/2)

Chemical Property of 4-(2-(N,N-Diphenethylamino)ethyl)pyrocatechol oxalate (2:1)

Chemical Property:

• Vapor Pressure: 4.68E-13mmHg at 25°C
• Boiling Point: 558°C at 760 mmHg
• Flash Point: 292°C
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 19
• Exact Mass: 812.40366675
• Heavy Atom Count: 60
• Complexity: 439

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CCN(CCC2=CC=CC=C2)CCC3=CC(=C(C=C3)O)O.C1=CC=C(C=C1)CCN(CCC2=CC=CC=C2)CCC3=CC(=C(C=C3)O)O.C(=O)(C(=O)O)O

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