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Home > Boronic Acids > 126120-87-4
126120-87-4 | Boronic acid, B-(2,2-difluoro-1,3-benzodioxol-4-yl)-
CAS No: 126120-87-4 Catalog No: AG000RO6 MDL No:MFCD08062343
Product Description
Catalog Number:
AG000RO6
Chemical Name:
Boronic acid, B-(2,2-difluoro-1,3-benzodioxol-4-yl)-
CAS Number:
126120-87-4
Molecular Formula:
C7H5BF2O4
Molecular Weight:
201.9200
MDL Number:
MFCD08062343
IUPAC Name:
(2,2-difluoro-1,3-benzodioxol-4-yl)boronic acid
InChI:
InChI=1S/C7H5BF2O4/c9-7(10)13-5-3-1-2-4(8(11)12)6(5)14-7/h1-3,11-12H
InChI Key:
GCIIKWAIWSFGLA-UHFFFAOYSA-N
SMILES:
OB(c1cccc2c1OC(O2)(F)F)O
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.025g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.92g/mol
Monoisotopic Mass:
202.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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