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Home > Boronic Acids > 145349-62-8
145349-62-8 | Boronic acid, B-(2-chloro-4-methylphenyl)-
CAS No: 145349-62-8 Catalog No: AG001KTP MDL No:MFCD03411936
Product Description
Catalog Number:
AG001KTP
Chemical Name:
Boronic acid, B-(2-chloro-4-methylphenyl)-
CAS Number:
145349-62-8
Molecular Formula:
C7H8BClO2
Molecular Weight:
170.4012
MDL Number:
MFCD03411936
IUPAC Name:
(2-chloro-4-methylphenyl)boronic acid
InChI:
InChI=1S/C7H8BClO2/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4,10-11H,1H3
InChI Key:
UKYCKUPXBPLXBA-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)Cl)B(O)O
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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