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Home > Boronic Acids > 1416244-48-8
1416244-48-8 | Boronic acid, B-(4,5-difluoro-2-methylphenyl)-
CAS No: 1416244-48-8 Catalog No: AG001GOM MDL No:MFCD12911676
Product Description
Catalog Number:
AG001GOM
Chemical Name:
Boronic acid, B-(4,5-difluoro-2-methylphenyl)-
CAS Number:
1416244-48-8
Molecular Formula:
C7H7BF2O2
Molecular Weight:
171.9371
MDL Number:
MFCD12911676
IUPAC Name:
(4,5-difluoro-2-methylphenyl)boronic acid
InChI:
InChI=1S/C7H7BF2O2/c1-4-2-6(9)7(10)3-5(4)8(11)12/h2-3,11-12H,1H3
InChI Key:
RUSKIGNGLQRANK-UHFFFAOYSA-N
SMILES:
OB(c1cc(F)c(cc1C)F)O
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
171.938g/mol
Monoisotopic Mass:
172.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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