Methyl (2E,3S,4S,5E)-4-Hydroxy-2-(Methoxymethylene)-3-Methyl-6-Phenyl-5-Hexenoate

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Properties Simple | Detailed

Formula C16H20O4
IUPAC Name methyl (e,2e,3s,4s)-4-hydroxy-2-(methoxymethylene)-3-methyl-6-phenyl-hex-5-enoate
Molecular Mass 276.328 g·mol−1
Heat of Formation -554.5 ± 16.7 kJ·mol−1
Dipole Moment 3.75 ± 1.08 D
Volume 350.73 Å 3
Surface Area 300.93 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-(3s,4s)-4-hydroxy-2-methoxymethylene-3-methyl-6-phenyl-hex-5-enoic acid, methyl ester
  • noroudemansin a
InChIKey REMSURQDUDTWHG-QRKSDAOCSA-N
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Elements H C O