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Home > Boronic Acids > 1449131-69-4
1449131-69-4 | 4-Chloro-3-(3-methylphenylcarbamoyl)benzeneboronic acid
CAS No: 1449131-69-4 Catalog No: AG00HX8V MDL No:
Product Description
Catalog Number:
AG00HX8V
Chemical Name:
4-Chloro-3-(3-methylphenylcarbamoyl)benzeneboronic acid
CAS Number:
1449131-69-4
IUPAC Name:
[4-chloro-3-[(3-methylphenyl)carbamoyl]phenyl]boronic acid
InChI:
InChI=1S/C14H13BClNO3/c1-9-3-2-4-11(7-9)17-14(18)12-8-10(15(19)20)5-6-13(12)16/h2-8,19-20H,1H3,(H,17,18)
InChI Key:
VJELBFGEHAWNRK-UHFFFAOYSA-N
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.068g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
289.522g/mol
Monoisotopic Mass:
289.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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