(2S,3S)-2-Isohexyl-3-[(1S)-1-Methylbutyl]Oxirane

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Properties Simple | Detailed

Formula C13H26O
IUPAC Name (2s,3s)-2-isohexyl-3-[(1s)-1-methylbutyl]oxirane
Molecular Mass 198.345 g·mol−1
Heat of Formation -314.8 ± 16.7 kJ·mol−1
Dipole Moment 2.05 ± 1.08 D
Volume 301.81 Å 3
Surface Area 286.87 Å 2
HOMO Energy -10.19 ± 0.55 eV
LUMO Energy 5.43 ± eV
Point Group Symmetry C1
InChIKey MPTSUYPJICHFMF-AVGNSLFASA-N
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Elements H C O