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4'-(3-Bromo-9-acridinylamino)methanesulfonanilide

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Name

4'-(3-Bromo-9-acridinylamino)methanesulfonanilide

EINECS N/A
CAS No. 58682-45-4 Density 1.616g/cm3
PSA 82.70000 LogP 5.84130
Solubility N/A Melting Point N/A
Formula C20H16BrN3O2S Boiling Point 593.9°Cat760mmHg
Molecular Weight 442.36 Flash Point 313°C
Transport Information N/A Appearance N/A
Safety Mutation data reported. When heated to decomposition it emits very toxic fumes of Br, NOx, and SOx. See also SULFONATES. Risk Codes N/A
Molecular Structure Molecular Structure of 58682-45-4 (N-[4-[(3-Bromo-9-acridinyl)amino]phenyl]methanesulfonamide) Hazard Symbols N/A
Synonyms

4'-(3-Bromo-9-acridinylamino)methanesulfonanilide;Methanesulfonanilide,4'-((3-bromo-9-acridinyl)amino);N-{4-[(3-bromoacridin-9-yl)amino]phenyl}methanesulfonamide;

 

4'-(3-Bromo-9-acridinylamino)methanesulfonanilide Chemical Properties

Empirical Formula of 4'-(3-Bromo-9-acridinylamino)methanesulfonanilide (CAS NO.58682-45-4): C20H16BrN3O2S
Molecular Weight: 442.3289 
Index of Refraction: 1.762
Density: 1.616 g/cm3
Flash Point: 313 °C
Enthalpy of Vaporization: 88.54 kJ/mol
Boiling Point: 593.9 °C at 760 mmHg
Vapour Pressure: 4.47E-14 mmHg at 25 °C
Structure of 4'-(3-Bromo-9-acridinylamino)methanesulfonanilide (CAS NO.58682-45-4):
                            
IUPAC Name: N-[4-[(3-Bromoacridin-9-yl)amino]phenyl]methanesulfonamide
Canonical SMILES: CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)Br
InChI: InChI=1S/C20H16BrN3O2S/c1-27(25,26)24-15-9-7-14(8-10-15)22-20-16-4-2-3-5-18(16)23-19-12-13(21)6-11-17(19)20/h2-12,24H,1H3,(H,22,23)
InChIKey: UTJTTYAOWDXHNW-UHFFFAOYSA-N

4'-(3-Bromo-9-acridinylamino)methanesulfonanilide Toxicity Data With Reference

1.    

mmo-sat 25 µmol/L

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

4'-(3-Bromo-9-acridinylamino)methanesulfonanilide Safety Profile

Mutation data reported. When heated to decomposition 4'-(3-Bromo-9-acridinylamino)methanesulfonanilide (CAS NO.58682-45-4) emits very toxic fumes of Br, NOx, and SOx. See also SULFONATES.

4'-(3-Bromo-9-acridinylamino)methanesulfonanilide Specification

 4'-(3-Bromo-9-acridinylamino)methanesulfonanilide , its cas register number is 58682-45-4. It also can be called N-[4-(3-Bromo-acridin-9-ylamino)-phenyl]-methanesulfonamide ; BRN 0452379 ; and Methanesulfonanilide, 4'-((3-bromo-9-acridinyl)amino)- .

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