(1S,9R)-1,4:3,9-Dianhydro-1-[(1S)-3-Bromopropadienyl]-9-[(1R)-1-Bromopropyl]-2,5,8-Trideoxy-L-Gluco-Nonitol

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Properties Simple | Detailed

Formula C15H22Br2O4
IUPAC Name (2s,3ar,5r,7s,8r,9ar)-2-(3-bromopropa-1,2-dienyl)-5-[(1r)-1-bromopropyl]-3,3a,5,6,7,8,9,9a-octahydro-2h-furo[3,2-b]oxocine-7,8-diol
Molecular Mass 426.141 g·mol−1
Heat of Formation -630.5 ± 16.7 kJ·mol−1
Dipole Moment 5.20 ± 1.08 D
Volume 402.24 Å 3
Surface Area 340.97 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy 2.73 ± eV
Point Group Symmetry C1
InChIKey BKHFTVFNYNKPGW-GRBQAUPASA-N
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Elements H C Br O