1,3-Butanedione, 4,4,4-trifluoro-1-[3-(trifluoromethyl)phenyl]-


Chemical Name: 1,3-Butanedione, 4,4,4-trifluoro-1-[3-(trifluoromethyl)phenyl]-
CAS Number: 94856-24-3
Product Number: AG019KMK(AGN-PC-00UXW0)
Synonyms:
MDL No: MFCD07779626
Molecular Formula: C11H6F6O2
Molecular Weight: 284.1546

Identification/Properties


Computed Properties
Molecular Weight:
284.157g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
3
Exact Mass:
284.027g/mol
Monoisotopic Mass:
284.027g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
357
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


Other Analytical Data


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