4-(Bis(4-(ethylamino)-3-methylphenyl)methyl)benzene-1,3-disulphonic acid

Base Information

• Chemical Name: 4-(Bis(4-(ethylamino)-3-methylphenyl)methyl)benzene-1,3-disulphonic acid
• CAS No.: 94166-75-3
• Molecular Formula: C25H30 N2 O6 S2
• Molecular Weight: 518.6455
• European Community (EC) Number: 303-373-0
• DSSTox Substance ID: DTXSID00240924
• Nikkaji Number: J319.030G
• Wikidata: Q83124086
• Mol file: 94166-75-3.mol

Synonyms:94166-75-3;4-(Bis(4-(ethylamino)-3-methylphenyl)methyl)benzene-1,3-disulphonic acid;EINECS 303-373-0;4-[bis[4-(ethylamino)-3-methylphenyl]methyl]benzene-1,3-disulphonic acid;SCHEMBL13046350;DTXSID00240924;4-[Bis[4-(ethylamino)-3-methylphenyl]methyl]-1,3-benzenedisulfonic acid

Chemical Property of 4-(Bis(4-(ethylamino)-3-methylphenyl)methyl)benzene-1,3-disulphonic acid

Chemical Property:

• Melting Point: >300 °C(lit.)
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.355g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 518.15452903
• Heavy Atom Count: 35
• Complexity: 855

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)NCC)C)C3=C(C=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)C