(1S,3R,4R,5S)-1,3,4-Trihydroxy-5-(3-Phenoxypropyl)Cyclohexanecarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C16H22O6 |
IUPAC Name | (1s,3r,4r,5s)-1,3,4-trihydroxy-5-(3-phenoxypropyl)cyclohexanecarboxylic acid |
Molecular Mass | 310.342 g·mol−1 |
Heat of Formation | -1108.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.27 ± 1.08 D |
Volume | 370.2 Å 3 |
Surface Area | 334.27 Å 2 |
HOMO Energy | -8.90 ± 0.55 eV |
LUMO Energy | 3.25 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | SCUFESRLGCQXRX-DCDXPUDHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |