Home Sulfos 4-Bromo-N-cyclopropyl-3-nitrobenzenesulfonamide

4-Bromo-N-cyclopropyl-3-nitrobenzenesulfonamide

CAS No.:
1449412-80-9
Catalog Number:
AG00HXCE
Molecular Formula:
C9H9BrN2O4S
Molecular Weight:
321.1478
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Product Description
Catalog Number:
AG00HXCE
Chemical Name:
4-Bromo-N-cyclopropyl-3-nitrobenzenesulfonamide
CAS Number:
1449412-80-9
Molecular Formula:
C9H9BrN2O4S
Molecular Weight:
321.1478
MDL Number:
MFCD26097284
IUPAC Name:
4-bromo-N-cyclopropyl-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C9H9BrN2O4S/c10-8-4-3-7(5-9(8)12(13)14)17(15,16)11-6-1-2-6/h3-6,11H,1-2H2
InChI Key:
KHIYLDKUMPVDIV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Br)S(=O)(=O)NC1CC1
Properties
Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.947g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
321.145g/mol
Monoisotopic Mass:
319.947g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties