Strobilurin D

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Properties Simple | Detailed

Formula C26H34O6
IUPAC Name methyl (2e,3e,5z)-6-[3-[[(2s)-3,3-dimethyloxiran-2-yl]methoxy]-4-(3-methylbut-2-enoxy)phenyl]-2-(methoxymethylene)-3-methyl-hexa-3,5-dienoate
Molecular Mass 442.545 g·mol−1
Heat of Formation -759.8 ± 16.7 kJ·mol−1
Dipole Moment 1.94 ± 1.08 D
Volume 568.44 Å 3
Surface Area 415.07 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,3e,5z)-6-[3-[[(2s)-3,3-dimethyl-2-oxiranyl]methoxy]-4-(3-methylbut-2-enoxy)phenyl]-2-(methoxymethylene)-3-methylhexa-3,5-dienoic acid methyl ester
  • (2e,3e,5z)-6-[3-[[(2s)-3,3-dimethyloxiran-2-yl]methoxy]-4-(3-methylbut-2-enoxy)phenyl]-2-(methoxymethylene)-3-methyl-hexa-3,5-dienoic acid methyl ester
  • 3,5-hexadienoic acid, 6-(3-((3,3-dimethyloxiranyl)methoxy)-4-((3-methyl-2-butenyl)oxy)phenyl)-2-(methoxymethylene)-3-methyl-, methyl ester, (s-(e,z,e))-
  • methyl (2e,3e,5z)-6-[3-[[(2s)-3,3-dimethyloxiran-2-yl]methoxy]-4-(3-methylbut-2-enoxy)phenyl]-2-(methoxymethylene)-3-methyl-hexa-3,5-dienoate
  • methyl (2e,3e,5z)-6-[3-[[(2s)-3,3-dimethyloxiran-2-yl]methoxy]-4-(3-methylbut-2-enoxy)phenyl]-2-(methoxymethylidene)-3-methyl-hexa-3,5-dienoate
  • methyl (2e,3e,5z)-6-[3-[[(2s)-3,3-dimethyloxiran-2-yl]methoxy]-4-(3-methylbut-2-enoxy)phenyl]-2-(methoxymethylidene)-3-methylhexa-3,5-dienoate
CAS Number(s)
  • 132056-04-3
InChIKey YNBNAVIYNFSXMV-XVUWDRIOSA-N
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