(1S,5R,6S)-5-Hydroxy-3-(Hydroxymethyl)-7-Oxabicyclo[4.1.0]Hept-3-En-2-One
Properties
Property | Value |
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Formula | C7H8O4 |
IUPAC Name | (1s,2r,6s)-2-hydroxy-4-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-en-5-one |
Molecular Mass | 156.136 g·mol−1 |
Heat of Formation | -485.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.10 ± 1.08 D |
Volume | 170.32 Å 3 |
Surface Area | 169.53 Å 2 |
HOMO Energy | -10.62 ± 0.55 eV |
LUMO Energy | 1.85 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | VTLJDPHPVHSVGR-PRMYIZFSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |