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Home > Boronic Acids > 1025736-43-9
1025736-43-9 | Boronic acid, B-(3',4'-dichloro[1,1'-biphenyl]-4-yl)-
CAS No: 1025736-43-9 Catalog No: AG0007S1 MDL No:MFCD08544390
Product Description
Catalog Number:
AG0007S1
Chemical Name:
Boronic acid, B-(3',4'-dichloro[1,1'-biphenyl]-4-yl)-
CAS Number:
1025736-43-9
Molecular Formula:
C12H9BCl2O2
Molecular Weight:
266.9157
MDL Number:
MFCD08544390
IUPAC Name:
[4-(3,4-dichlorophenyl)phenyl]boronic acid
InChI:
InChI=1S/C12H9BCl2O2/c14-11-6-3-9(7-12(11)15)8-1-4-10(5-2-8)13(16)17/h1-7,16-17H
InChI Key:
HKWYWWYEYYTNGU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)c1ccc(c(c1)Cl)Cl)O
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.007g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.912g/mol
Monoisotopic Mass:
266.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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