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Home > Boronic Acids > 1449142-52-2
1449142-52-2 | 3-(2,4-Dimethylphenylcarbamoyl)-4-fluorobenzeneboronic acid
CAS No: 1449142-52-2 Catalog No: AG00HXAS MDL No:
Product Description
Catalog Number:
AG00HXAS
Chemical Name:
3-(2,4-Dimethylphenylcarbamoyl)-4-fluorobenzeneboronic acid
CAS Number:
1449142-52-2
IUPAC Name:
[3-[(2,4-dimethylphenyl)carbamoyl]-4-fluorophenyl]boronic acid
InChI:
InChI=1S/C15H15BFNO3/c1-9-3-6-14(10(2)7-9)18-15(19)12-8-11(16(20)21)4-5-13(12)17/h3-8,20-21H,1-2H3,(H,18,19)
InChI Key:
NAGZPMGVPYUELX-UHFFFAOYSA-N
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.113g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
287.097g/mol
Monoisotopic Mass:
287.113g/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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