Formula |
C18H18O8 |
IUPAC Name |
[(1r,2r,4r,5s,6r,7s)-5,6-diacetoxy-3,8-dioxatricyclo[5.1.0.02,4]octan-4-yl]methyl benzoate |
Molecular Mass |
362.331 g·mol−1 |
Heat of Formation |
-1069.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.09 ± 1.08 D |
Volume |
401.87 Å 3 |
Surface Area |
323.32 Å 2 |
HOMO Energy |
-10.40 ± 0.55 eV |
LUMO Energy |
-0.81 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 3,8-dioxatricyclo[5.1.0.0(2,4)]octane-5,6-diol, 4-(hydroxymethyl)-, 5,6-diacetate 4-benzoate
- 4-((benzoyloxy)methyl)3,8-dioxatricyclo(5.1.0.0)-octane-5,6-diol diacetate
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CAS Number(s) |
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InChIKey |
ASAWUXMEXFAFMU-DBDULZNHSA-N |
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Links |
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Elements |
H
C
O
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