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1449142-68-0

1449142-68-0 | 3-(4-Chloro-2-methylphenylcarbamoyl)-2-fluorobenzeneboronic acid

CAS No: 1449142-68-0 Catalog No: AG00HXAZ MDL No:

Product Description

Catalog Number:
AG00HXAZ
Chemical Name:
3-(4-Chloro-2-methylphenylcarbamoyl)-2-fluorobenzeneboronic acid
CAS Number:
1449142-68-0
IUPAC Name:
[3-[(4-chloro-2-methylphenyl)carbamoyl]-2-fluorophenyl]boronic acid
InChI:
InChI=1S/C14H12BClFNO3/c1-8-7-9(16)5-6-12(8)18-14(19)10-3-2-4-11(13(10)17)15(20)21/h2-7,20-21H,1H3,(H,18,19)
InChI Key:
GBXFNILAZLGQRB-UHFFFAOYSA-N

Properties

Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.058g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
307.512g/mol
Monoisotopic Mass:
307.058g/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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