Home Boronic acids (4-Methanesulfonyl-3-methylphenyl)boronic acid

(4-Methanesulfonyl-3-methylphenyl)boronic acid

CAS No.:
1598437-51-4
Catalog Number:
AG00HYKJ
Molecular Formula:
C8H11BO4S
Molecular Weight:
214.0465
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$438
- +
5g
95%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00HYKJ
Chemical Name:
(4-Methanesulfonyl-3-methylphenyl)boronic acid
CAS Number:
1598437-51-4
Molecular Formula:
C8H11BO4S
Molecular Weight:
214.0465
MDL Number:
MFCD27935684
IUPAC Name:
(3-methyl-4-methylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C8H11BO4S/c1-6-5-7(9(10)11)3-4-8(6)14(2,12)13/h3-5,10-11H,1-2H3
InChI Key:
MNXHZJUIACFVQC-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)C)S(=O)(=O)C)O
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.047g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
214.042g/mol
Monoisotopic Mass:
214.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties