4-{(2S)-2-Hydroxy-3-[4-(2-Methyl-2-Propanyl)Phenoxy]Propoxy}Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C20H24O5 |
IUPAC Name | 4-[(2s)-3-(4-tert-butylphenoxy)-2-hydroxy-propoxy]benzoic acid |
Molecular Mass | 344.402 g·mol−1 |
Heat of Formation | -800.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.19 ± 1.08 D |
Volume | 430.68 Å 3 |
Surface Area | 360.89 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | -0.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | PXODZCMXOZRVEN-MRXNPFEDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |