(1S)-1,5-Anhydro-1-(4-Chloro-2,5-Dihydroxyphenyl)-D-Glucitol
Properties
Property | Value |
---|---|
Formula | C12H15ClO7 |
IUPAC Name | (2s,3r,4r,5s,6r)-2-(4-chloro-2,5-dihydroxy-phenyl)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol |
Molecular Mass | 306.696 g·mol−1 |
Heat of Formation | -1259.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.95 ± 1.08 D |
Volume | 322.12 Å 3 |
Surface Area | 284.0 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | -0.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | LHMIFDKRIZSEFV-ZIQFBCGOSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Cl |