200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1035235-29-0
1035235-29-0 | 4-Cyano-2-fluorophenylboronic acid, pinacol ester
CAS No: 1035235-29-0 Catalog No: AG008SGC MDL No:MFCD09998162
Product Description
Catalog Number:
AG008SGC
Chemical Name:
4-Cyano-2-fluorophenylboronic acid, pinacol ester
CAS Number:
1035235-29-0
Molecular Formula:
C13H15BFNO2
Molecular Weight:
247.0731
MDL Number:
MFCD09998162
IUPAC Name:
3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
InChI:
InChI=1S/C13H15BFNO2/c1-12(2)13(3,4)18-14(17-12)10-6-5-9(8-16)7-11(10)15/h5-7H,1-4H3
InChI Key:
FEUINZSEHIJUBU-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.118g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.076g/mol
Monoisotopic Mass:
247.118g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.