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CAS No.: | 29968-68-1 |
---|---|
Name: | N-4-Biphenylyl-N-hydroxybenzenesulfonamide |
Molecular Structure: | |
Formula: | C18H15 N O3 S |
Molecular Weight: | 325.388 |
Synonyms: | Benzenesulfonanilide,N-hydroxy-4'-phenyl- (8CI) |
Density: | 1.336g/cm3 |
Boiling Point: | 541.4°Cat760mmHg |
Flash Point: | 281.2°C |
Safety: | Questionable carcinogen with experimental neoplastigenic data. See also SULFONATES. When heated to decomposition it emits very toxic fumes of SOx and NOx. |
PSA: | 65.99000 |
LogP: | 5.01890 |
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Molecule structure of N-4-Biphenylyl-N-hydroxybenzenesulfonamide (CAS NO.29968-68-1):
IUPAC Name: N-Hydroxy-N-(4-phenylphenyl)benzenesulfonamide
Molecular Weight: 325.3816 g/mol
Molecular Formula: C18H15NO3S
Density: 1.336 g/cm3
Boiling Point: 541.4 °C at 760 mmHg
Flash Point: 281.2 °C
Index of Refraction: 1.665
Molar Refractivity: 90.4 cm3
Molar Volume: 243.3 cm3
Polarizability: 35.83×10-24 cm3
Surface Tension: 58.3 dyne/cm
Enthalpy of Vaporization: 86.23 kJ/mol
Vapour Pressure: 1.48E-12 mmHg at 25 °C
XLogP3-AA: 3.8
H-Bond Donor: 1
H-Bond Acceptor: 4
Rotatable Bond Count: 4
Exact Mass: 325.077264
MonoIsotopic Mass: 325.077264
Topological Polar Surface Area: 57.6
Heavy Atom Count: 23
Complexity: 453
Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)N(O)S(=O)(=O)C3=CC=CC=C3
InChI: InChI=1S/C18H15NO3S/c20-19(23(21,22)18-9-5-2-6-10-18)17-13-11-16(12-14-17)15-7-3-1-4-8-15/h1-14,20H
InChIKey: AVKIDMWZECPVTA-UHFFFAOYSA-N
Questionable carcinogen with experimental neoplastigenic data. See also SULFONATES. When heated to decomposition it emits very toxic fumes of SOx and NOx.
N-4-Biphenylyl-N-hydroxybenzenesulfonamide (CAS NO.29968-68-1) is also named as BRN 2881808 ; Hydroxy-4-biphenylylbenzenesulfonamide ; Benzenesulfonamide, N-4-biphenylyl-N-hydroxy- . N-4-Biphenylyl-N-hydroxybenzenesulfonamide (CAS NO.29968-68-1) 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.