Home Sulfos [(4-Bromobenzyl)sulfonyl]acetic acid

[(4-Bromobenzyl)sulfonyl]acetic acid

CAS No.:
81431-45-0
Catalog Number:
AG0052LZ
Molecular Formula:
C9H9BrO4S
Molecular Weight:
293.1344
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
98%
In Stock USA
United States
$214
- +
Product Description
Catalog Number:
AG0052LZ
Chemical Name:
[(4-Bromobenzyl)sulfonyl]acetic acid
CAS Number:
81431-45-0
Molecular Formula:
C9H9BrO4S
Molecular Weight:
293.1344
MDL Number:
MFCD09934120
IUPAC Name:
2-[(4-bromophenyl)methylsulfonyl]acetic acid
InChI:
InChI=1S/C9H9BrO4S/c10-8-3-1-7(2-4-8)5-15(13,14)6-9(11)12/h1-4H,5-6H2,(H,11,12)
InChI Key:
VMYFZBLZKJJKLR-UHFFFAOYSA-N
SMILES:
OC(=O)CS(=O)(=O)Cc1ccc(cc1)Br
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.94g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.131g/mol
Monoisotopic Mass:
291.94g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties