(1S)-1,5-Anhydro-1-(4-Bromo-2,5-Dihydroxyphenyl)-D-Glucitol

Molecule SVG Image

Properties Simple | Detailed

Formula C12H15BrO7
IUPAC Name (2s,3r,4r,5s,6r)-2-(4-bromo-2,5-dihydroxy-phenyl)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 351.147 g·mol−1
Heat of Formation -1202.9 ± 16.7 kJ·mol−1
Dipole Moment 4.82 ± 1.08 D
Volume 328.76 Å 3
Surface Area 288.82 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
InChIKey UXXJNKKJRCGMAK-ZIQFBCGOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C Br O