Chemical Properties of M-nitrobenzenesulfonamide (CAS 121-52-8)

M-nitrobenzenesulfonamide

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InChI
InChI=1S/C6H6N2O4S/c7-13(11,12)6-3-1-2-5(4-6)8(9)10/h1-4H,(H2,7,11,12)
InChI Key
TXTQURPQLVHJRE-UHFFFAOYSA-N
Formula
C6H6N2O4S
SMILES
NS(=O)(=O)c1cccc([N+](=O)[O-])c1
Molecular Weight1
202.19
CAS
121-52-8
Other Names
  • 3-Nitrobenzolesulfamide
  • Benzenesulfonamide, 3-nitro-
  • Benzenesulfonamide, m-nitro-
  • m-Nitrobenzenesulfonamide
  • m-nitrobenzenesulphonamide
Sources

Physical Properties

Property Value Unit Source
Δf -264.12 kJ/mol Joback Calculated Property
Δfgas -372.43 kJ/mol Joback Calculated Property
Δfus 32.88 kJ/mol Joback Calculated Property
Δvap 77.75 kJ/mol Joback Calculated Property
logPoct/wat 0.24 Crippen Calculated Property
Pc 6359.24 kPa Joback Calculated Property
Tboil 640.49 K Joback Calculated Property
Tc 890.70 K Joback Calculated Property
Tfus 435.65 ± 1.50 K NIST
Vc 0.50 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 301.69 J/mol×K 640.49 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 4
-NO2 1
-NH2 1
=C< (ring) 2
-S- 1
=O 2

Similar Compounds

Benzenesulfonyl fluoride, m-nitro-. m-Nitrobenzensulfonic acid. m-Aminobenzenesulfonamide. Sulfanilanilide, 3-nitro-4-n-phenyl-. Benzenesulfonamide, 4-(dipropylamino)-3,5-dinitro-. 4-Bromo-3-nitrobenzene sulfonic acid. 2-Chloro-5-nitrobenzene sulfonic acid. O-aminobenzenesulfonamide. Methyl 4-nitrophenyl sulfone. Benzenesulfonamide, 4-amino-. O-toluenesulfonanilide, 5-amino. 2-Nitrobenzenesulfonyl fluoride. Benzenesulfonamide, 3-amino-n-butyl-4-methoxy-. 2-Amino-4-chlorobenzenesulfonamide. 4-Isothiocyanatobenzenesulfonamide.

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