Mandelic Acid 3,3,5-Trimethylcyclohexyl Ester
Properties
Property | Value |
---|---|
Formula | C17H24O3 |
IUPAC Name | [(1r,5r)-3,3,5-trimethylcyclohexyl] (2r)-2-hydroxy-2-phenyl-acetate |
Molecular Mass | 276.371 g·mol−1 |
Heat of Formation | -622.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.13 ± 1.08 D |
Volume | 360.54 Å 3 |
Surface Area | 310.98 Å 2 |
HOMO Energy | -9.75 ± 0.55 eV |
LUMO Energy | -0.03 ± eV |
Point Group Symmetry | C1 |
InChIKey | WZHCOOQXZCIUNC-NWANDNLSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |