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Home > Boronic Acids > 1256346-01-6
1256346-01-6 | Boronic acid, B-[3-(1-methylethoxy)-5-(trifluoromethoxy)phenyl]-
CAS No: 1256346-01-6 Catalog No: AG000O1S MDL No:MFCD16295063
Product Description
Catalog Number:
AG000O1S
Chemical Name:
Boronic acid, B-[3-(1-methylethoxy)-5-(trifluoromethoxy)phenyl]-
CAS Number:
1256346-01-6
Molecular Formula:
C10H12BF3O4
Molecular Weight:
264.0061
MDL Number:
MFCD16295063
IUPAC Name:
[3-propan-2-yloxy-5-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C10H12BF3O4/c1-6(2)17-8-3-7(11(15)16)4-9(5-8)18-10(12,13)14/h3-6,15-16H,1-2H3
InChI Key:
ZOSBEBVLVCKJTI-UHFFFAOYSA-N
SMILES:
CC(Oc1cc(cc(c1)B(O)O)OC(F)(F)F)C
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.078g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.007g/mol
Monoisotopic Mass:
264.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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