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Home Boronic acids 3-(Benzylcarbamoyl)-5-fluorophenylboronic acid

3-(Benzylcarbamoyl)-5-fluorophenylboronic acid

CAS No.:
874219-41-7
Catalog Number:
AG004G74
Molecular Formula:
C14H13BFNO3
Molecular Weight:
273.0673
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
25g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG004G74
Chemical Name:
3-(Benzylcarbamoyl)-5-fluorophenylboronic acid
CAS Number:
874219-41-7
Molecular Formula:
C14H13BFNO3
Molecular Weight:
273.0673
MDL Number:
MFCD08235058
IUPAC Name:
[3-(benzylcarbamoyl)-5-fluorophenyl]boronic acid
InChI:
InChI=1S/C14H13BFNO3/c16-13-7-11(6-12(8-13)15(19)20)14(18)17-9-10-4-2-1-3-5-10/h1-8,19-20H,9H2,(H,17,18)
InChI Key:
SPKWRVWDQVGUAK-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)B(O)O)C(=O)NCc1ccccc1
Properties
Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.097g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
273.07g/mol
Monoisotopic Mass:
273.097g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties