5-Methylhexanoyl (1R,2S)-2-Methylcyclobutanecarboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C13H22O3
IUPAC Name 5-methylhexanoyl (1r,2s)-2-methylcyclobutanecarboxylate
Molecular Mass 226.312 g·mol−1
Heat of Formation -675.5 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 305.66 Å 3
Surface Area 286.21 Å 2
HOMO Energy -10.52 ± 0.55 eV
LUMO Energy 3.62 ± eV
Point Group Symmetry C1
InChIKey UOPCSRHNSGUFSQ-WDEREUQCSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O