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Home Boronic acids 5-Acetylthiophene-2-boronic acid

5-Acetylthiophene-2-boronic acid

CAS No.:
206551-43-1
Catalog Number:
AG002IJN
Molecular Formula:
C6H7BO3S
Molecular Weight:
169.9940
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$28
- +
25g
98%
In Stock USA
United States
$107
- +
100g
98%
In Stock USA
United States
$407
- +
Product Description
Catalog Number:
AG002IJN
Chemical Name:
5-Acetylthiophene-2-boronic acid
CAS Number:
206551-43-1
Molecular Formula:
C6H7BO3S
Molecular Weight:
169.9940
MDL Number:
MFCD01075681
IUPAC Name:
(5-acetylthiophen-2-yl)boronic acid
InChI:
InChI=1S/C6H7BO3S/c1-4(8)5-2-3-6(11-5)7(9)10/h2-3,9-10H,1H3
InChI Key:
DCNMATSPQKWETQ-UHFFFAOYSA-N
SMILES:
OB(c1ccc(s1)C(=O)C)O
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.021g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
169.989g/mol
Monoisotopic Mass:
170.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Synthesis and evaluation of 3-(dihydroxyboryl)benzoic acids as D,D-carboxypeptidase R39 inhibitors. Journal of medicinal chemistry 20091008
CA224, a non-planar analogue of fascaplysin, inhibits Cdk4 but not Cdk2 and arrests cells at G0/G1 inhibiting pRB phosphorylation. Bioorganic & medicinal chemistry letters 20060815
Properties