Acetyl (3S)-3-Methylhexanoate

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Properties Simple | Detailed

Formula C9H16O3
IUPAC Name acetyl (3s)-3-methylhexanoate
Molecular Mass 172.222 g·mol−1
Heat of Formation -693.3 ± 16.7 kJ·mol−1
Dipole Moment 4.19 ± 1.08 D
Volume 230.31 Å 3
Surface Area 227.22 Å 2
HOMO Energy -10.70 ± 0.55 eV
LUMO Energy 3.57 ± eV
Point Group Symmetry C1
InChIKey CAGWCJIYELMZKY-ZETCQYMHSA-N
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