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Home > Boronic Acids > 175425-95-3
175425-95-3 | Boronic acid, B-[4-(decyloxy)-2-fluorophenyl]-
CAS No: 175425-95-3 Catalog No: AG0020YY MDL No:
Product Description
Catalog Number:
AG0020YY
Chemical Name:
Boronic acid, B-[4-(decyloxy)-2-fluorophenyl]-
CAS Number:
175425-95-3
Molecular Formula:
C16H26BFO3
Molecular Weight:
296.1852
IUPAC Name:
(4-decoxy-2-fluorophenyl)boronic acid
InChI:
InChI=1S/C16H26BFO3/c1-2-3-4-5-6-7-8-9-12-21-14-10-11-15(17(19)20)16(18)13-14/h10-11,13,19-20H,2-9,12H2,1H3
InChI Key:
LMHUJPLLLBRKMX-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCOc1ccc(c(c1)F)B(O)O
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.196g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
296.189g/mol
Monoisotopic Mass:
296.196g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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