Home Boronic acids 5-Cyano-4-methylthiophene-2-boronic acid

5-Cyano-4-methylthiophene-2-boronic acid

CAS No.:
1119899-50-1
Catalog Number:
AG003BXX
Molecular Formula:
C6H6BNO2S
Molecular Weight:
166.9933
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG003BXX
Chemical Name:
5-Cyano-4-methylthiophene-2-boronic acid
CAS Number:
1119899-50-1
Molecular Formula:
C6H6BNO2S
Molecular Weight:
166.9933
MDL Number:
MFCD12546494
IUPAC Name:
(5-cyano-4-methylthiophen-2-yl)boronic acid
InChI:
InChI=1S/C6H6BNO2S/c1-4-2-6(7(9)10)11-5(4)3-8/h2,9-10H,1H3
InChI Key:
GTCXNUVYZCKGCH-UHFFFAOYSA-N
SMILES:
N#Cc1sc(cc1C)B(O)O
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.021g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
166.989g/mol
Monoisotopic Mass:
167.021g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
92.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties