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Home Boronic acids 3-(Benzyloxycarbonylamino)-4-fluorophenylboronic acid

3-(Benzyloxycarbonylamino)-4-fluorophenylboronic acid

CAS No.:
874219-58-6
Catalog Number:
AG008DKG
Molecular Formula:
C14H13BFNO4
Molecular Weight:
289.0667
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$313
- +
5g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG008DKG
Chemical Name:
3-(Benzyloxycarbonylamino)-4-fluorophenylboronic acid
CAS Number:
874219-58-6
Molecular Formula:
C14H13BFNO4
Molecular Weight:
289.0667
MDL Number:
MFCD19237159
IUPAC Name:
[4-fluoro-3-(phenylmethoxycarbonylamino)phenyl]boronic acid
InChI:
InChI=1S/C14H13BFNO4/c16-12-7-6-11(15(19)20)8-13(12)17-14(18)21-9-10-4-2-1-3-5-10/h1-8,19-20H,9H2,(H,17,18)
InChI Key:
IKYWKFFZZURZER-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc(ccc1F)B(O)O)OCc1ccccc1
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.092g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
289.069g/mol
Monoisotopic Mass:
289.092g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties