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Home > Nitro Compounds > 89840-82-4
89840-82-4 | N,N-Diethyl-4-nitrobenzenesulfonamide
CAS No: 89840-82-4 Catalog No: AG003YRV MDL No:MFCD00451495
Product Description
Catalog Number:
AG003YRV
Chemical Name:
N,N-Diethyl-4-nitrobenzenesulfonamide
CAS Number:
89840-82-4
Molecular Formula:
C10H14N2O4S
Molecular Weight:
258.2942
MDL Number:
MFCD00451495
IUPAC Name:
N,N-diethyl-4-nitrobenzenesulfonamide
InChI:
InChI=1S/C10H14N2O4S/c1-3-11(4-2)17(15,16)10-7-5-9(6-8-10)12(13)14/h5-8H,3-4H2,1-2H3
InChI Key:
SONXVVRXIQJXIP-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])CC
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.067g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.292g/mol
Monoisotopic Mass:
258.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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