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Home > Boronic Acids > 2096332-76-0
2096332-76-0 | 5-Ethoxy-2-fluoro-3-(trifluoromethyl)phenylboronic acid
CAS No: 2096332-76-0 Catalog No: AG01EHKH MDL No:MFCD19981509
Product Description
Catalog Number:
AG01EHKH
Chemical Name:
5-Ethoxy-2-fluoro-3-(trifluoromethyl)phenylboronic acid
CAS Number:
2096332-76-0
MDL Number:
MFCD19981509
IUPAC Name:
[5-ethoxy-2-fluoro-3-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C9H9BF4O3/c1-2-17-5-3-6(9(12,13)14)8(11)7(4-5)10(15)16/h3-4,15-16H,2H2,1H3
InChI Key:
HLNNKYHTOVDUGK-UHFFFAOYSA-N
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.058g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.972g/mol
Monoisotopic Mass:
252.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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