Home Boronic acids 3-(Methylsulfonylmethyl)phenylboronic acid pinacol ester

3-(Methylsulfonylmethyl)phenylboronic acid pinacol ester

CAS No.:
1864802-09-4
Catalog Number:
AG00I1TF
Molecular Formula:
C14H21BO4S
Molecular Weight:
296.1901
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:
AG00I1TF
Chemical Name:
3-(Methylsulfonylmethyl)phenylboronic acid pinacol ester
CAS Number:
1864802-09-4
Molecular Formula:
C14H21BO4S
Molecular Weight:
296.1901
MDL Number:
MFCD18734144
IUPAC Name:
4,4,5,5-tetramethyl-2-[3-(methylsulfonylmethyl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H21BO4S/c1-13(2)14(3,4)19-15(18-13)12-8-6-7-11(9-12)10-20(5,16)17/h6-9H,10H2,1-5H3
InChI Key:
MCILNMLIKSDFJL-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)Cc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
436  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.125g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.188g/mol
Monoisotopic Mass:
296.125g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties