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Home > Boronic Acids > 1335048-35-5
1335048-35-5 | 3,5-dichloro-4-hydroxyphenylboronic acid
CAS No: 1335048-35-5 Catalog No: AG009ZZO MDL No:MFCD19105364
Product Description
Catalog Number:
AG009ZZO
Chemical Name:
3,5-dichloro-4-hydroxyphenylboronic acid
CAS Number:
1335048-35-5
Molecular Formula:
C6H5BCl2O3
Molecular Weight:
206.8191
MDL Number:
MFCD19105364
IUPAC Name:
(3,5-dichloro-4-hydroxyphenyl)boronic acid
InChI:
InChI=1S/C6H5BCl2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10-12H
InChI Key:
PLWASSWLQMNNCS-UHFFFAOYSA-N
SMILES:
OB(c1cc(Cl)c(c(c1)Cl)O)O
Properties
Complexity:
146
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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