Home Boronic acids 2-Amino-4-trifluoropyrimidine-5-boronic acid pinacol ester

2-Amino-4-trifluoropyrimidine-5-boronic acid pinacol ester

CAS No.:
944401-58-5
Catalog Number:
AG00H7IW
Molecular Formula:
C11H15BF3N3O2
Molecular Weight:
289.0619
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$492
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Product Description
Catalog Number:
AG00H7IW
Chemical Name:
2-Amino-4-trifluoropyrimidine-5-boronic acid pinacol ester
CAS Number:
944401-58-5
Molecular Formula:
C11H15BF3N3O2
Molecular Weight:
289.0619
MDL Number:
MFCD09952051
IUPAC Name:
5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine
InChI:
InChI=1S/C11H15BF3N3O2/c1-9(2)10(3,4)20-12(19-9)6-5-17-8(16)18-7(6)11(13,14)15/h5H,1-4H3,(H2,16,17,18)
InChI Key:
FEVSQCNVVXXUBK-UHFFFAOYSA-N
SMILES:
Nc1ncc(c(n1)C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.121g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
289.065g/mol
Monoisotopic Mass:
289.121g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties