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Home > Boronic Acids > 162101-31-7
162101-31-7 | Boronic acid, B-(2-fluoro-4-methoxyphenyl)-
CAS No: 162101-31-7 Catalog No: AG001SQO MDL No:MFCD04039323
Product Description
Catalog Number:
AG001SQO
Chemical Name:
Boronic acid, B-(2-fluoro-4-methoxyphenyl)-
CAS Number:
162101-31-7
Molecular Formula:
C7H8BFO3
Molecular Weight:
169.9460
MDL Number:
MFCD04039323
IUPAC Name:
(2-fluoro-4-methoxyphenyl)boronic acid
InChI:
InChI=1S/C7H8BFO3/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4,10-11H,1H3
InChI Key:
ULUIXJDBPYBAHS-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)F)B(O)O
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.055g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.946g/mol
Monoisotopic Mass:
170.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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