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Home > Boronic Acids > 1256346-26-5
1256346-26-5 | Boronic acid, B-[4-chloro-2-fluoro-3-(2-methoxyethoxy)phenyl]-
CAS No: 1256346-26-5 Catalog No: AG000O19 MDL No:MFCD17015741
Product Description
Catalog Number:
AG000O19
Chemical Name:
Boronic acid, B-[4-chloro-2-fluoro-3-(2-methoxyethoxy)phenyl]-
CAS Number:
1256346-26-5
Molecular Formula:
C9H11BClFO4
Molecular Weight:
248.4436
MDL Number:
MFCD17015741
IUPAC Name:
[4-chloro-2-fluoro-3-(2-methoxyethoxy)phenyl]boronic acid
InChI:
InChI=1S/C9H11BClFO4/c1-15-4-5-16-9-7(11)3-2-6(8(9)12)10(13)14/h2-3,13-14H,4-5H2,1H3
InChI Key:
FUXWTCCXYLIMOQ-UHFFFAOYSA-N
SMILES:
COCCOc1c(Cl)ccc(c1F)B(O)O
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.042g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
248.441g/mol
Monoisotopic Mass:
248.042g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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