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Home > Boronic Acids > 1334218-91-5
1334218-91-5 | (5-fluoro-2-((2-methoxyethoxy)methyl)phenyl)boronic acid
CAS No: 1334218-91-5 Catalog No: AG01FL79 MDL No:
Product Description
Catalog Number:
AG01FL79
Chemical Name:
(5-fluoro-2-((2-methoxyethoxy)methyl)phenyl)boronic acid
CAS Number:
1334218-91-5
Molecular Formula:
C10H14BFO4
Molecular Weight:
228.0252
IUPAC Name:
[5-fluoro-2-(2-methoxyethoxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C10H14BFO4/c1-15-4-5-16-7-8-2-3-9(12)6-10(8)11(13)14/h2-3,6,13-14H,4-5,7H2,1H3
InChI Key:
DTQLLLGBSKKXFL-UHFFFAOYSA-N
SMILES:
COCCOCc1ccc(cc1B(O)O)F
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.097g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.026g/mol
Monoisotopic Mass:
228.097g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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