Home Boronic acids Benzothiazole-6-boronic acid, pinacol ester

Benzothiazole-6-boronic acid, pinacol ester

CAS No.:
1002309-47-8
Catalog Number:
AG0001AQ
Molecular Formula:
C13H16BNO2S
Molecular Weight:
261.1476
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$150
- +
1g
98%
In Stock USA
United States
$350
- +
5g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG0001AQ
Chemical Name:
Benzothiazole-6-boronic acid, pinacol ester
CAS Number:
1002309-47-8
Molecular Formula:
C13H16BNO2S
Molecular Weight:
261.1476
MDL Number:
MFCD12408395
IUPAC Name:
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzothiazole
InChI:
InChI=1S/C13H16BNO2S/c1-12(2)13(3,4)17-14(16-12)9-5-6-10-11(7-9)18-8-15-10/h5-8H,1-4H3
InChI Key:
VLJNKSRMMHATGX-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc2c(c1)scn2
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.099g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.146g/mol
Monoisotopic Mass:
261.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties