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Home > Nitro Compounds > 89840-91-5
89840-91-5 | Benzenesulfonamide, N-ethyl-4-methyl-2-nitro-
CAS No: 89840-91-5 Catalog No: AG003XHB MDL No:
Product Description
Catalog Number:
AG003XHB
Chemical Name:
Benzenesulfonamide, N-ethyl-4-methyl-2-nitro-
CAS Number:
89840-91-5
Molecular Formula:
C9H12N2O4S
Molecular Weight:
244.2676
IUPAC Name:
N-ethyl-4-methyl-2-nitrobenzenesulfonamide
InChI:
InChI=1S/C9H12N2O4S/c1-3-10-16(14,15)9-5-4-7(2)6-8(9)11(12)13/h4-6,10H,3H2,1-2H3
InChI Key:
SPWQUIGXXICJDA-UHFFFAOYSA-N
SMILES:
CCNS(=O)(=O)c1ccc(cc1[N+](=O)[O-])C
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.052g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.265g/mol
Monoisotopic Mass:
244.052g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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