Home Boronic acids 1-Phenylsulfonylindole-6-boronic acid

1-Phenylsulfonylindole-6-boronic acid

CAS No.:
480438-52-6
Catalog Number:
AG003BEE
Molecular Formula:
C14H12BNO4S
Molecular Weight:
301.1254
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$132
- +
5g
95%
In Stock USA
United States
$394
- +
Product Description
Catalog Number:
AG003BEE
Chemical Name:
1-Phenylsulfonylindole-6-boronic acid
CAS Number:
480438-52-6
Molecular Formula:
C14H12BNO4S
Molecular Weight:
301.1254
MDL Number:
MFCD03840611
IUPAC Name:
[1-(benzenesulfonyl)indol-6-yl]boronic acid
InChI:
InChI=1S/C14H12BNO4S/c17-15(18)12-7-6-11-8-9-16(14(11)10-12)21(19,20)13-4-2-1-3-5-13/h1-10,17-18H
InChI Key:
RVWRLLZYYUIBOX-UHFFFAOYSA-N
SMILES:
OB(c1ccc2c(c1)n(cc2)S(=O)(=O)c1ccccc1)O
Properties
Complexity:
458  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.058g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
301.123g/mol
Monoisotopic Mass:
301.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties