2-Fluoro-2-Phenyl-1,3-Propanediyl Dicarbamate

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Properties Simple | Detailed

Formula C11H13FN2O4
IUPAC Name (3-carbamoyloxy-2-fluoro-2-phenyl-propyl) carbamate
Molecular Mass 256.230 g·mol−1
Heat of Formation -851.2 ± 16.7 kJ·mol−1
Dipole Moment 4.43 ± 1.08 D
Volume 286.73 Å 3
Surface Area 269.71 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry Cs
Synonyms
  • (3-aminocarbonyloxy-2-fluoro-2-phenyl-propyl) carbamate
  • (3-carbamoyloxy-2-fluoro-2-phenylpropyl) carbamate
  • carbamic acid (3-carbamoyloxy-2-fluoro-2-phenyl-propyl) ester
  • carbamic acid (3-carbamoyloxy-2-fluoro-2-phenylpropyl) ester
  • fluorofelbamate
CAS Number(s)
  • 726-99-8
InChIKey ZCDHNOUTBZTCLP-UHFFFAOYSA-N
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Elements H C N O F