8-Chloro-6-(trifluoromethyl)quinolin-4(1H)-one


Chemical Name: 8-Chloro-6-(trifluoromethyl)quinolin-4(1H)-one
CAS Number: 1065092-49-0
Product Number: AG00998G(AGN-PC-0WAGHE)
Synonyms:
MDL No:
Molecular Formula: C10H5ClF3NO
Molecular Weight: 247.6010

Identification/Properties


Computed Properties
Molecular Weight:
247.601g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
247.001g/mol
Monoisotopic Mass:
247.001g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
329
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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