Home Boronic acids 5-Cyanothiophene-2-boronic acid

5-Cyanothiophene-2-boronic acid

CAS No.:
305832-67-1
Catalog Number:
AG0030LD
Molecular Formula:
C5H4BNO2S
Molecular Weight:
152.9668
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$25
- +
5g
97%
In Stock USA
United States
$100
- +
10g
97%
In Stock USA
United States
$175
- +
25g
97%
In Stock USA
United States
$350
- +
100g
97%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG0030LD
Chemical Name:
5-Cyanothiophene-2-boronic acid
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
Properties