3,4-O-[(1S)-1-Carboxyethylidene]-β-D-Galactopyranose

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Properties Simple | Detailed

Formula C9H14O8
IUPAC Name (2r,3as,4r,6r,7r,7ar)-6,7-dihydroxy-4-(hydroxymethyl)-2-methyl-4,6,7,7a-tetrahydro-3ah-[1,3]dioxolo[4,5-c]pyran-2-carboxylic acid
Molecular Mass 250.203 g·mol−1
Heat of Formation -1477.1 ± 16.7 kJ·mol−1
Dipole Moment 3.22 ± 1.08 D
Volume 261.32 Å 3
Surface Area 228.99 Å 2
HOMO Energy -10.06 ± 0.55 eV
LUMO Energy -0.00 ± eV
Point Group Symmetry C1
InChIKey KLSAAUGREIROIS-BDIBXJNUSA-N
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Elements H C O