4-(2,4-Dihydroxy-2,6,6-Trimethylcyclohexylidene)-3-Buten-2-One
Properties
Property | Value |
---|---|
Formula | C13H20O3 |
IUPAC Name | 4-[(2r,4s)-2,4-dihydroxy-2,6,6-trimethyl-cyclohexylidene]but-3-en-2-one |
Molecular Mass | 224.296 g·mol−1 |
Heat of Formation | -540.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.11 ± 1.08 D |
Volume | 297.91 Å 3 |
Surface Area | 256.64 Å 2 |
HOMO Energy | -9.70 ± 0.55 eV |
LUMO Energy | 2.98 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | QMXLZUOHZGYGDY-JBGXHEPSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |