Home Sulfos N-(-Bromovaleryl)methanesulfonamide

N-(-Bromovaleryl)methanesulfonamide

CAS No.:
52533-64-9
Catalog Number:
AG00E2NA
Molecular Formula:
C6H12BrNO3S
Molecular Weight:
258.1334
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Product Description
Catalog Number:
AG00E2NA
Chemical Name:
N-(-Bromovaleryl)methanesulfonamide
CAS Number:
52533-64-9
Molecular Formula:
C6H12BrNO3S
Molecular Weight:
258.1334
MDL Number:
MFCD25964182
IUPAC Name:
5-bromo-N-methylsulfonylpentanamide
InChI:
InChI=1S/C6H12BrNO3S/c1-12(10,11)8-6(9)4-2-3-5-7/h2-5H2,1H3,(H,8,9)
InChI Key:
LLHBJNWMKOAJDD-UHFFFAOYSA-N
SMILES:
BrCCCCC(=O)NS(=O)(=O)C
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.972g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.13g/mol
Monoisotopic Mass:
256.972g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties