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872495-46-0 | Borinic acid, bis(3-chloro-4-fluorophenyl)-
CAS No: 872495-46-0 Catalog No: AG004R26 MDL No:
Product Description
Catalog Number:
AG004R26
Chemical Name:
Borinic acid, bis(3-chloro-4-fluorophenyl)-
CAS Number:
872495-46-0
Molecular Formula:
C12H7BCl2F2O
Molecular Weight:
286.8972
IUPAC Name:
bis(3-chloro-4-fluorophenyl)borinic acid
InChI:
InChI=1S/C12H7BCl2F2O/c14-9-5-7(1-3-11(9)16)13(18)8-2-4-12(17)10(15)6-8/h1-6,18H
InChI Key:
OHSYVPROJRWIBT-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)Cl)F)c1ccc(c(c1)Cl)F
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.994g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.894g/mol
Monoisotopic Mass:
285.994g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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