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CAS No.: | 13607-48-2 |
---|---|
Name: | N-4-Biphenylylbenzenesulfonamide |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C18H15 N O2 S |
Molecular Weight: | 309.389 |
Synonyms: | Benzenesulfonanilide,4'-phenyl- (6CI,8CI); NSC 95766 |
Density: | 1.268g/cm3 |
Boiling Point: | 484.7°Cat760mmHg |
Flash Point: | 247°C |
Safety: | Questionable carcinogen with experimental tumorigenic data. See also SULFONATES. When heated to decomposition it emits very toxic fumes of SOx and NOx. |
PSA: | 54.55000 |
LogP: | 5.30820 |
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Molecule structure of N-4-Biphenylylbenzenesulfonamide (CAS NO.13607-48-2):
IUPAC Name: N-(4-Phenylphenyl)benzenesulfonamide
Molecular Weight: 309.3822 g/mol
Molecular Formula: C18H15NO2S
Density: 1.268 g/cm3
Boiling Point: 484.7 °C at 760 mmHg
Flash Point: 247 °C
Index of Refraction: 1.647
Molar Refractivity: 88.63 cm3
Molar Volume: 243.8 cm3
Polarizability: 35.13×10-24 cm3
Surface Tension: 52.8 dyne/cm
Enthalpy of Vaporization: 75.01 kJ/mol
Vapour Pressure: 1.5E-09 mmHg at 25 °C
XLogP3: 4.2
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 4
Exact Mass: 309.082349
MonoIsotopic Mass: 309.082349
Topological Polar Surface Area: 46.2
Heavy Atom Count: 22
Complexity: 423
Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3
InChI: InChI=1S/C18H15NO2S/c20-22(21,18-9-5-2-6-10-18)19-17-13-11-16(12-14-17)15-7-3-1-4-8-15/h1-14,19H
InChIKey: JMNQYDKGYHLAMY-UHFFFAOYSA-N
Questionable carcinogen with experimental tumorigenic data. See also SULFONATES. When heated to decomposition it emits very toxic fumes of SOx and NOx.
N-4-Biphenylylbenzenesulfonamide (CAS NO.13607-48-2) is also named as 3-12-00-03184 (Beilstein Handbook Reference) ; BRN 2813375 ; Benzenesulfonamide, N-4-biphenylyl- ; NSC 95766 ; Benzenesulfonanilide, 4'-phenyl- (8CI) . N-4-Biphenylylbenzenesulfonamide (CAS NO.13607-48-2) is toxic. It is flammable. It will produce toxic nitrogen oxide and sulfur oxide fumes when buring. So the storage environment should be ventilate, low-temperature and dry.