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88345-58-8 | Benzenesulfonamide, 4-acetyl-2-chloro-3-nitro-
CAS No: 88345-58-8 Catalog No: AG0047Q7 MDL No:
Product Description
Catalog Number:
AG0047Q7
Chemical Name:
Benzenesulfonamide, 4-acetyl-2-chloro-3-nitro-
CAS Number:
88345-58-8
Molecular Formula:
C8H7ClN2O5S
Molecular Weight:
278.6696
IUPAC Name:
4-acetyl-2-chloro-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C8H7ClN2O5S/c1-4(12)5-2-3-6(17(10,15)16)7(9)8(5)11(13)14/h2-3H,1H3,(H2,10,15,16)
InChI Key:
AZGRDXJEJRWYDG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(ccc(c1Cl)S(=O)(=O)N)C(=O)C
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.976g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.663g/mol
Monoisotopic Mass:
277.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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