Home Boronic acids 1-(Phenylsulfonyl)-3-indoleboronic acid pinacol ester

1-(Phenylsulfonyl)-3-indoleboronic acid pinacol ester

CAS No.:
870717-93-4
Catalog Number:
AG003D42
Molecular Formula:
C20H22BNO4S
Molecular Weight:
383.2690
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG003D42
Chemical Name:
1-(Phenylsulfonyl)-3-indoleboronic acid pinacol ester
CAS Number:
870717-93-4
Molecular Formula:
C20H22BNO4S
Molecular Weight:
383.2690
MDL Number:
MFCD08276778
IUPAC Name:
1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole
InChI:
InChI=1S/C20H22BNO4S/c1-19(2)20(3,4)26-21(25-19)17-14-22(18-13-9-8-12-16(17)18)27(23,24)15-10-6-5-7-11-15/h5-14H,1-4H3
InChI Key:
OMZLHWZHHPAZPW-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cn(c2c1cccc2)S(=O)(=O)c1ccccc1
Properties
Complexity:
637  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.136g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
383.269g/mol
Monoisotopic Mass:
383.136g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
65.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties