200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1150561-65-1
1150561-65-1 | 1-Pentanone, 1-[4-fluoro-3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
CAS No: 1150561-65-1 Catalog No: AG000FT0 MDL No:MFCD12026098
Product Description
Catalog Number:
AG000FT0
Chemical Name:
1-Pentanone, 1-[4-fluoro-3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
CAS Number:
1150561-65-1
Molecular Formula:
C23H35B2FO5
Molecular Weight:
432.1414
MDL Number:
MFCD12026098
IUPAC Name:
1-[4-fluoro-3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pentan-1-one
InChI:
InChI=1S/C23H35B2FO5/c1-10-11-12-18(27)15-13-16(24-28-20(2,3)21(4,5)29-24)19(26)17(14-15)25-30-22(6,7)23(8,9)31-25/h13-14H,10-12H2,1-9H3
InChI Key:
PNCWXQQEKHXUIE-UHFFFAOYSA-N
SMILES:
CCCCC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)B1OC(C(O1)(C)C)(C)C)F
Properties
Complexity:
603
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
432.265g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
432.146g/mol
Monoisotopic Mass:
432.265g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.