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88522-44-5 | Benzenesulfonamide, N-[4-(bromoacetyl)phenyl]-2,5-dichloro-
CAS No: 88522-44-5 Catalog No: AG004822 MDL No:
Product Description
Catalog Number:
AG004822
Chemical Name:
Benzenesulfonamide, N-[4-(bromoacetyl)phenyl]-2,5-dichloro-
CAS Number:
88522-44-5
Molecular Formula:
C14H10BrCl2NO3S
Molecular Weight:
423.1091
IUPAC Name:
N-[4-(2-bromoacetyl)phenyl]-2,5-dichlorobenzenesulfonamide
InChI:
InChI=1S/C14H10BrCl2NO3S/c15-8-13(19)9-1-4-11(5-2-9)18-22(20,21)14-7-10(16)3-6-12(14)17/h1-7,18H,8H2
InChI Key:
ZQNFVKVNHAEPGI-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc(cc1)NS(=O)(=O)c1cc(Cl)ccc1Cl
Properties
Complexity:
489
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.894g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
423.102g/mol
Monoisotopic Mass:
420.894g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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