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Home > Boronic Acids > 1256346-44-7
1256346-44-7 | Boronic acid, B-(2,4-dichloro-5-hydroxyphenyl)-
CAS No: 1256346-44-7 Catalog No: AG000O24 MDL No:MFCD17015749
Product Description
Catalog Number:
AG000O24
Chemical Name:
Boronic acid, B-(2,4-dichloro-5-hydroxyphenyl)-
CAS Number:
1256346-44-7
Molecular Formula:
C6H5BCl2O3
Molecular Weight:
206.8191
MDL Number:
MFCD17015749
IUPAC Name:
(2,4-dichloro-5-hydroxyphenyl)boronic acid
InChI:
InChI=1S/C6H5BCl2O3/c8-4-2-5(9)6(10)1-3(4)7(11)12/h1-2,10-12H
InChI Key:
QGQYVVHOORCAAV-UHFFFAOYSA-N
SMILES:
OB(c1cc(O)c(cc1Cl)Cl)O
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.971g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
206.813g/mol
Monoisotopic Mass:
205.971g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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