Benzenebutanoic acid, 2,4-difluoro-g-oxo-


Chemical Name: Benzenebutanoic acid, 2,4-difluoro-g-oxo-
CAS Number: 110931-77-6
Product Number: AG007BPU(AGN-PC-0P1CNE)
Synonyms:
MDL No:
Molecular Formula: C10H8F2O3
Molecular Weight: 214.1655

Identification/Properties


Computed Properties
Molecular Weight:
214.168g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
214.044g/mol
Monoisotopic Mass:
214.044g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
255
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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