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