Home Sulfos 5-Bromo-2-methylbenzenesulfonic acid

5-Bromo-2-methylbenzenesulfonic acid

CAS No.:
56919-17-6
Catalog Number:
AG00EBCG
Molecular Formula:
C7H7BrO3S
Molecular Weight:
251.0977
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$438
- +
5g
98%
In Stock USA
United States
$1375
- +
Product Description
Catalog Number:
AG00EBCG
Chemical Name:
5-Bromo-2-methylbenzenesulfonic acid
CAS Number:
56919-17-6
Molecular Formula:
C7H7BrO3S
Molecular Weight:
251.0977
MDL Number:
MFCD09271824
IUPAC Name:
5-bromo-2-methylbenzenesulfonic acid
InChI:
InChI=1S/C7H7BrO3S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,1H3,(H,9,10,11)
InChI Key:
NQVLVDGTVIOCGB-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)S(=O)(=O)O)C
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.93g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.094g/mol
Monoisotopic Mass:
249.93g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties