(5R,6S)-7-Methylene-8-Oxo-5-(3,4,5-Trimethoxyphenyl)-5,6,7,8-Tetrahydronaphtho[2,3-D][1,3]Dioxole-6-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C22H20O8 |
IUPAC Name | (7s,8r)-6-methylene-5-oxo-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid |
Molecular Mass | 412.389 g·mol−1 |
Heat of Formation | -993.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.01 ± 1.08 D |
Volume | 457.58 Å 3 |
Surface Area | 380.58 Å 2 |
HOMO Energy | -9.01 ± 0.55 eV |
LUMO Energy | -0.77 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | HLSXUNBUCPHTDA-RTBURBONSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |