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Home > Nitro Compounds > 96950-96-8
96950-96-8 | N-(4-ethoxyphenyl)-2-nitrobenzenesulfonamide
CAS No: 96950-96-8 Catalog No: AG00IJVN MDL No:MFCD00547843
Product Description
Catalog Number:
AG00IJVN
Chemical Name:
N-(4-ethoxyphenyl)-2-nitrobenzenesulfonamide
CAS Number:
96950-96-8
Molecular Formula:
C14H14N2O5S
Molecular Weight:
322.3364
MDL Number:
MFCD00547843
IUPAC Name:
N-(4-ethoxyphenyl)-2-nitrobenzenesulfonamide
InChI:
InChI=1S/C14H14N2O5S/c1-2-21-12-9-7-11(8-10-12)15-22(19,20)14-6-4-3-5-13(14)16(17)18/h3-10,15H,2H2,1H3
InChI Key:
UZFBYQMVVPSVIZ-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)NS(=O)(=O)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.062g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
322.335g/mol
Monoisotopic Mass:
322.062g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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