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Home > Boronic Acids > 148839-33-2
148839-33-2 | Boronic acid, B-(5-chloro-2-methylphenyl)-
CAS No: 148839-33-2 Catalog No: AG001L8R MDL No:MFCD03411939
Product Description
Catalog Number:
AG001L8R
Chemical Name:
Boronic acid, B-(5-chloro-2-methylphenyl)-
CAS Number:
148839-33-2
Molecular Formula:
C7H8BClO2
Molecular Weight:
170.4012
MDL Number:
MFCD03411939
IUPAC Name:
(5-chloro-2-methylphenyl)boronic acid
InChI:
InChI=1S/C7H8BClO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4,10-11H,1H3
InChI Key:
QWTHTSAWMJFMOV-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)B(O)O)C
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.031g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
170.399g/mol
Monoisotopic Mass:
170.031g/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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