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Home > Boronic Acids > 1186403-17-7

1186403-17-7

1186403-17-7 | (3-Bromo-5-chlorophenyl)boronic acid

CAS No: 1186403-17-7 Catalog No: AG0037WP MDL No:MFCD13189469

Product Description

Catalog Number:
AG0037WP
Chemical Name:
(3-Bromo-5-chlorophenyl)boronic acid
CAS Number:
1186403-17-7
Molecular Formula:
C6H5BBrClO2
Molecular Weight:
235.2707
MDL Number:
MFCD13189469
IUPAC Name:
(3-bromo-5-chlorophenyl)boronic acid
InChI:
InChI=1S/C6H5BBrClO2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,10-11H
InChI Key:
YLKZHZVQNASRAN-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)cc(c1)B(O)O

Properties

Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.925g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.268g/mol
Monoisotopic Mass:
233.925g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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