Home Boronic acids 2-(N-Cyclohexylaminomethyl)-3-fluorophenylboronic acid, pinacol ester, HCl

2-(N-Cyclohexylaminomethyl)-3-fluorophenylboronic acid, pinacol ester, HCl

CAS No.:
2096340-27-9
Catalog Number:
AG01EHK4
Molecular Formula:
C19H30BClFNO2
Molecular Weight:
369.7094
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG01EHK4
Chemical Name:
2-(N-Cyclohexylaminomethyl)-3-fluorophenylboronic acid, pinacol ester, HCl
CAS Number:
2096340-27-9
Molecular Formula:
C19H30BClFNO2
Molecular Weight:
369.7094
MDL Number:
MFCD20529514
IUPAC Name:
N-[[2-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]cyclohexanamine;hydrochloride
InChI:
InChI=1S/C19H29BFNO2.ClH/c1-18(2)19(3,4)24-20(23-18)16-11-8-12-17(21)15(16)13-22-14-9-6-5-7-10-14;/h8,11-12,14,22H,5-7,9-10,13H2,1-4H3;1H
InChI Key:
UIDDCJHQSKQMOM-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1CNC1CCCCC1)B1OC(C(O1)(C)C)(C)C.Cl
Properties
Complexity:
410  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.204g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
369.712g/mol
Monoisotopic Mass:
369.204g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties