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Home Boronic acids 2-Benzyloxy-5-fluorophenylboronic acid

2-Benzyloxy-5-fluorophenylboronic acid

CAS No.:
779331-47-4
Catalog Number:
AG008NXU
Molecular Formula:
C13H12BFO3
Molecular Weight:
246.0420
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$63
- +
25g
98%
In Stock USA
United States
$225
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG008NXU
Chemical Name:
2-Benzyloxy-5-fluorophenylboronic acid
CAS Number:
779331-47-4
Molecular Formula:
C13H12BFO3
Molecular Weight:
246.0420
MDL Number:
MFCD03788403
IUPAC Name:
(5-fluoro-2-phenylmethoxyphenyl)boronic acid
InChI:
InChI=1S/C13H12BFO3/c15-11-6-7-13(12(8-11)14(16)17)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2
InChI Key:
ULIJNMCAPASXHA-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)B(O)O)OCc1ccccc1
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.086g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
246.044g/mol
Monoisotopic Mass:
246.086g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Structure-activity relationship for aryl and heteroaryl boronic acid inhibitors of hormone-sensitive lipase. Bioorganic & medicinal chemistry 20050315
Properties