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Home Other Building Blocks N-t-Butyl 3-borono-4-fluorobenzamide

N-t-Butyl 3-borono-4-fluorobenzamide

CAS No.:
874289-51-7
Catalog Number:
AG0036BA
Molecular Formula:
C11H15BFNO3
Molecular Weight:
239.0511
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$198
- +
5g
96%
In Stock USA
United States
$788
- +
Product Description
Catalog Number:
AG0036BA
Chemical Name:
N-t-Butyl 3-borono-4-fluorobenzamide
CAS Number:
874289-51-7
Molecular Formula:
C11H15BFNO3
Molecular Weight:
239.0511
MDL Number:
MFCD08436054
IUPAC Name:
[5-(tert-butylcarbamoyl)-2-fluorophenyl]boronic acid
InChI:
InChI=1S/C11H15BFNO3/c1-11(2,3)14-10(15)7-4-5-9(13)8(6-7)12(16)17/h4-6,16-17H,1-3H3,(H,14,15)
InChI Key:
KKSGPXWRHLBCCW-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)B(O)O)F)NC(C)(C)C
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.113g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
239.053g/mol
Monoisotopic Mass:
239.113g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties