Strobilurin C

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Properties Simple | Detailed

Formula C21H26O4
IUPAC Name methyl (2e,3e,5z)-2-(methoxymethylene)-3-methyl-6-[3-(3-methylbut-2-enoxy)phenyl]hexa-3,5-dienoate
Molecular Mass 342.429 g·mol−1
Heat of Formation -485.1 ± 16.7 kJ·mol−1
Dipole Moment 3.44 ± 1.08 D
Volume 444.85 Å 3
Surface Area 381.18 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -0.10 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,3e,5z)-2-(methoxymethylene)-3-methyl-6-[3-(3-methylbut-2-enoxy)phenyl]hexa-3,5-dienoic acid methyl ester
  • 3,5-hexadienoic acid, 2-(methoxymethylene)-3-methyl-6-(3-((3-methyl-2-butenyl)oxy)phenyl)-, methyl ester, (e,e,e)-
  • 3,5-hexadienoic acid, 2-(methoxymethylene)-3-methyl-6-(3-((3-methyl-2-butenyl)oxy)phenyl)-, methyl ester, (e,z,e)-
  • methyl (2e,3e,5z)-2-(methoxymethylene)-3-methyl-6-[3-(3-methylbut-2-enoxy)phenyl]hexa-3,5-dienoate
  • methyl (2e,3e,5z)-2-(methoxymethylidene)-3-methyl-6-[3-(3-methylbut-2-enoxy)phenyl]hexa-3,5-dienoate
CAS Number(s)
  • 87081-57-0
InChIKey RIGZIGSLGOTINN-CQTSAADYSA-N
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