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1-(3,5-Difluorophenyl)-3-(1,3-dioxan-2-yl)-1-propanone
[CAS# 884504-29-4]

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Identification
Name 1-(3,5-Difluorophenyl)-3-(1,3-dioxan-2-yl)-1-propanone
Synonyms 3',5'-Difluoro-3-(1,3-Dioxan-2-Yl)Propiophenone; MFCD02261815
Molecular Structure CAS#: 884504-29-4, 1-(3,5-Difluorophenyl)-3-(1,3-dioxan-2-yl)-1-propanone
Molecular Formula C13H14F2O3
Molecular Weight 256.25
CAS Registry Number 884504-29-4
SMILES Fc1cc(cc(F)c1)C(=O)CCC2OCCCO2
InChI 1S/C13H14F2O3/c14-10-6-9(7-11(15)8-10)12(16)2-3-13-17-4-1-5-18-13/h6-8,13H,1-5H2
InChIKey IECPMEZZMQGHIJ-UHFFFAOYSA-N
Properties
Density 1.218g/cm3 (Cal.)
Boiling point 347.39°C at 760 mmHg (Cal.)
Flash point 158.428°C (Cal.)
Refractive index 1.487 (Cal.)
Safety Data
SDS Available
References
(1) S. S. Golotvin, E. Vodopianov, R. Pol, B. A. Lefebvre, A. J. Williams, R. D. Rutkowske and T. D. Spitzer. Automated structure verification based on a combination of 1D 1H NMR and 2D 1H–13C HSQC spectra, Magn. Reson. Chem. 2007, 45, 803–813
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