Home Boronic acids 4-Cyano-2-fluoro-5-methylphenylboronic acid, pinacol ester

4-Cyano-2-fluoro-5-methylphenylboronic acid, pinacol ester

CAS No.:
1192023-08-7
Catalog Number:
AG000ID0
Molecular Formula:
C14H17BFNO2
Molecular Weight:
261.0997
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$313
- +
1g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG000ID0
Chemical Name:
4-Cyano-2-fluoro-5-methylphenylboronic acid, pinacol ester
CAS Number:
1192023-08-7
Molecular Formula:
C14H17BFNO2
Molecular Weight:
261.0997
MDL Number:
MFCD12405378
IUPAC Name:
5-fluoro-2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
InChI:
InChI=1S/C14H17BFNO2/c1-9-6-11(12(16)7-10(9)8-17)15-18-13(2,3)14(4,5)19-15/h6-7H,1-5H3
InChI Key:
HTUJWJWTEQBFEF-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c(cc1C)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.134g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.103g/mol
Monoisotopic Mass:
261.134g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties