4-(Nitrooxy)Butyl 2-(2-Fluoro-4-Biphenylyl)Propanoate

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Properties Simple | Detailed

Formula C19H20FNO5
IUPAC Name 4-nitrooxybutyl (2r)-2-(3-fluoro-4-phenyl-phenyl)propanoate
Molecular Mass 361.364 g·mol−1
Heat of Formation -590.4 ± 16.7 kJ·mol−1
Dipole Moment 3.65 ± 1.08 D
Volume 424.42 Å 3
Surface Area 334.4 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 2.50 ± eV
Point Group Symmetry C1
InChIKey DLWSRGHNJVLJAH-CQSZACIVSA-N
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