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Home > Boronic Acids > 305832-67-1
305832-67-1 | Boronic acid, B-(5-cyano-2-thienyl)-
CAS No: 305832-67-1 Catalog No: AG0030LD MDL No:MFCD02094029
Product Description
Catalog Number:
AG0030LD
Chemical Name:
Boronic acid, B-(5-cyano-2-thienyl)-
CAS Number:
305832-67-1
Molecular Formula:
C5H4BNO2S
Molecular Weight:
152.9668
MDL Number:
MFCD02094029
IUPAC Name:
(5-cyanothiophen-2-yl)boronic acid
InChI:
InChI=1S/C5H4BNO2S/c7-3-4-1-2-5(10-4)6(8)9/h1-2,8-9H
InChI Key:
ZEOMEPSYIIQIND-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(s1)B(O)O
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.006g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
152.962g/mol
Monoisotopic Mass:
153.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.5A^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 |
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