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Home > Boronic Acids > 206551-43-1
206551-43-1 | Boronic acid, B-(5-acetyl-2-thienyl)-
CAS No: 206551-43-1 Catalog No: AG002IJN MDL No:MFCD01075681
Product Description
Catalog Number:
AG002IJN
Chemical Name:
Boronic acid, B-(5-acetyl-2-thienyl)-
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 |
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