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

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Properties Simple | Detailed

Formula C13H24O
IUPAC Name (2s,3r)-2-isohexyl-3-[(1s,2s)-2-methylcyclobutyl]oxirane
Molecular Mass 196.329 g·mol−1
Heat of Formation -211.8 ± 16.7 kJ·mol−1
Dipole Moment 2.13 ± 1.08 D
Volume 287.76 Å 3
Surface Area 271.36 Å 2
HOMO Energy -10.23 ± 0.55 eV
LUMO Energy 5.40 ± eV
Point Group Symmetry C1
InChIKey SEJCSXBJKTZZBL-ZDEQEGDKSA-N
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Elements H C O