200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1334401-01-2
1334401-01-2 | 3-fluoro-4-((4-Methylpiperazin-1-yl)Methyl)phenylboronic acid
CAS No: 1334401-01-2 Catalog No: AG009YI5 MDL No:MFCD16198075
Product Description
Catalog Number:
AG009YI5
Chemical Name:
3-fluoro-4-((4-Methylpiperazin-1-yl)Methyl)phenylboronic acid
CAS Number:
1334401-01-2
Molecular Formula:
C12H18BFN2O2
Molecular Weight:
252.0929
MDL Number:
MFCD16198075
IUPAC Name:
[3-fluoro-4-[(4-methylpiperazin-1-yl)methyl]phenyl]boronic acid
InChI:
InChI=1S/C12H18BFN2O2/c1-15-4-6-16(7-5-15)9-10-2-3-11(13(17)18)8-12(10)14/h2-3,8,17-18H,4-7,9H2,1H3
InChI Key:
HITTZMNYLRWKIZ-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)Cc1ccc(cc1F)B(O)O
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.145g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.096g/mol
Monoisotopic Mass:
252.145g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.