Home Boronic acids 4-(N,N-Diethylaminomethyl)-2-fluorophenylboronic acid, pinacol ester

4-(N,N-Diethylaminomethyl)-2-fluorophenylboronic acid, pinacol ester

CAS No.:
2096341-88-5
Catalog Number:
AG01EHJB
Molecular Formula:
C17H27BFNO2
Molecular Weight:
307.2112
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$150
- +
5g
97%
In Stock USA
United States
$450
- +
10g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG01EHJB
Chemical Name:
4-(N,N-Diethylaminomethyl)-2-fluorophenylboronic acid, pinacol ester
CAS Number:
2096341-88-5
Molecular Formula:
C17H27BFNO2
Molecular Weight:
307.2112
MDL Number:
MFCD18434464
IUPAC Name:
N-ethyl-N-[[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]ethanamine
InChI:
InChI=1S/C17H27BFNO2/c1-7-20(8-2)12-13-9-10-14(15(19)11-13)18-21-16(3,4)17(5,6)22-18/h9-11H,7-8,12H2,1-6H3
InChI Key:
OCEKBQBXAJETQT-UHFFFAOYSA-N
SMILES:
CCN(Cc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C)CC
Properties
Complexity:
358  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.212g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.216g/mol
Monoisotopic Mass:
307.212g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties