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88344-71-2 | Acetamide, N-[(2-chloro-3-nitro-4-phenoxyphenyl)sulfonyl]-
CAS No: 88344-71-2 Catalog No: AG0047QH MDL No:
Product Description
Catalog Number:
AG0047QH
Chemical Name:
Acetamide, N-[(2-chloro-3-nitro-4-phenoxyphenyl)sulfonyl]-
CAS Number:
88344-71-2
Molecular Formula:
C14H11ClN2O6S
Molecular Weight:
370.7649
IUPAC Name:
N-(2-chloro-3-nitro-4-phenoxyphenyl)sulfonylacetamide
InChI:
InChI=1S/C14H11ClN2O6S/c1-9(18)16-24(21,22)12-8-7-11(14(13(12)15)17(19)20)23-10-5-3-2-4-6-10/h2-8H,1H3,(H,16,18)
InChI Key:
WEQUCMBMJPDVCK-UHFFFAOYSA-N
SMILES:
CC(=O)NS(=O)(=O)c1ccc(c(c1Cl)[N+](=O)[O-])Oc1ccccc1
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.003g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.76g/mol
Monoisotopic Mass:
370.003g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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