Product Name

  • Name

    N-[4-(acridin-9-ylamino)-2-aminophenyl]methanesulfonamide

  • EINECS
  • CAS No. 72739-00-5
  • Density 1.457g/cm3
  • Solubility
  • Melting Point
  • Formula C20H18N4O2S
  • Boiling Point 584.7°Cat760mmHg
  • Molecular Weight 378.455
  • Flash Point 307.4°C
  • Transport Information
  • Appearance
  • Safety Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and SOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 72739-00-5 (N-[4-(acridin-9-ylamino)-2-aminophenyl]methanesulfonamide)
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

4'-(9-Acridinylamino)-2'-aminomethanesulfonanilide Chemical Properties

Molecule structure of 4'-(9-Acridinylamino)-2'-aminomethanesulfonanilide (CAS NO.72739-00-5) :

IUPAC Name: N-[4-(acridin-9-ylamino)-2-aminophenyl]methanesulfonamide 
Molecular Weight: 378.44752 g/mol
Molecular Formula: C20H18N4O2S 
Density: 1.457 g/cm3 
Boiling Point: 584.7 °C at 760 mmHg 
Flash Point: 307.4 °C
Molar Volume: 259.6 cm3
Polarizability: 43.1*10-24 cm3
Surface Tension: 77.4 dyne/cm 
Enthalpy of Vaporization: 87.37 kJ/mol
Vapour Pressure: 1.17E-13 mmHg at 25 °C
XLogP3-AA: 3.4
H-Bond Donor: 3
H-Bond Acceptor: 6
Rotatable Bond Count: 4
Tautomer Count: 2
Exact Mass: 378.115047
MonoIsotopic Mass: 378.115047
Topological Polar Surface Area: 97.1
Heavy Atom Count: 27
Complexity: 586
Canonical SMILES: CS(=O)(=O)NC1=C(C=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)N
InChI: InChI=1S/C20H18N4O2S/c1-27(25,26)24-19-11-10-13(12-16(19)21)22-20-14-6-2-4-8-17(14)23-18-9-5-3-7-15(18)20/h2-12,24H,21H2,1H3,(H,22,23)
InChIKey of 4'-(9-Acridinylamino)-2'-aminomethanesulfonanilide (CAS NO.72739-00-5) : RQPPMOXSZXIXKM-UHFFFAOYSA-N

4'-(9-Acridinylamino)-2'-aminomethanesulfonanilide Toxicity Data With Reference

1.    

mmo-sat 42 µmol/L

     JMCMAR    Journal of Medicinal Chemistry. 23 (1980),269.

4'-(9-Acridinylamino)-2'-aminomethanesulfonanilide Safety Profile

Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and SOx.

4'-(9-Acridinylamino)-2'-aminomethanesulfonanilide Specification

 4'-(9-Acridinylamino)-2'-aminomethanesulfonanilide (CAS NO.72739-00-5) is also called 5-22-11-00029 (Beilstein Handbook Reference) ; BRN 0450429 ; Methanesulfonanilide, 4'-(9-acridinylamino)-2'-amino- .

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