Home Boronic acids 4-(BOC-amino)-3-fluorophenyl boronic acid, pinacol ester

4-(BOC-amino)-3-fluorophenyl boronic acid, pinacol ester

CAS No.:
262444-42-8
Catalog Number:
AG002SF3
Molecular Formula:
C17H25BFNO4
Molecular Weight:
337.1941
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$88
- +
5g
97%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG002SF3
Chemical Name:
4-(BOC-amino)-3-fluorophenyl boronic acid, pinacol ester
CAS Number:
262444-42-8
Molecular Formula:
C17H25BFNO4
Molecular Weight:
337.1941
MDL Number:
MFCD23701601
IUPAC Name:
tert-butyl N-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
InChI:
InChI=1S/C17H25BFNO4/c1-15(2,3)22-14(21)20-13-9-8-11(10-12(13)19)18-23-16(4,5)17(6,7)24-18/h8-10H,1-7H3,(H,20,21)
InChI Key:
KETIHPKFQXFMTA-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(cc1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
462  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.186g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
337.198g/mol
Monoisotopic Mass:
337.186g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties