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Home > Boronic Acids > 1217500-66-7
1217500-66-7 | Boronic acid, B-[2-fluoro-3-(2-methylpropoxy)phenyl]-
CAS No: 1217500-66-7 Catalog No: AG0015R6 MDL No:MFCD12546465
Product Description
Catalog Number:
AG0015R6
Chemical Name:
Boronic acid, B-[2-fluoro-3-(2-methylpropoxy)phenyl]-
CAS Number:
1217500-66-7
Molecular Formula:
C10H14BFO3
Molecular Weight:
212.0258
MDL Number:
MFCD12546465
IUPAC Name:
[2-fluoro-3-(2-methylpropoxy)phenyl]boronic acid
InChI:
InChI=1S/C10H14BFO3/c1-7(2)6-15-9-5-3-4-8(10(9)12)11(13)14/h3-5,7,13-14H,6H2,1-2H3
InChI Key:
BWKSJTLWBHWGNM-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1F)OCC(C)C)O
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.102g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.027g/mol
Monoisotopic Mass:
212.102g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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