Isopropyl 1-Thio-β-D-Glycero-Hexopyranoside

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Properties Simple | Detailed

Formula C9H18O5S
IUPAC Name (2r,3r,4r,5s,6s)-2-(hydroxymethyl)-6-isopropylsulfanyl-tetrahydropyran-3,4,5-triol
Molecular Mass 238.301 g·mol−1
Heat of Formation -996.1 ± 16.7 kJ·mol−1
Dipole Moment 2.24 ± 1.08 D
Volume 278.07 Å 3
Surface Area 245.43 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 2.75 ± eV
Point Group Symmetry C1
InChIKey BPHPUYQFMNQIOC-DMAGGPPCSA-N
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