1,3-Cyclohexanedione, 5-(4-fluorophenyl)-


Chemical Name: 1,3-Cyclohexanedione, 5-(4-fluorophenyl)-
CAS Number: 55579-72-1
Product Number: AG003M5V(AGN-PC-0JVKS5)
Synonyms:
MDL No:
Molecular Formula: C12H11FO2
Molecular Weight: 206.2129

Identification/Properties


Computed Properties
Molecular Weight:
206.216g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
206.074g/mol
Monoisotopic Mass:
206.074g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
251
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

Safety Information


NMR Spectrum


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