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Chemical structure of Methyleugenol

GC38962

Methyleugenol

Also listed as Methyl Eugenol

Methyl Eugenol, a phenylpropanoid chemical in leaves, fruits, stems, and/or roots, may be released when that corresponding part of a plant is damaged as a result of feeding by an herbivore

ChemicalCAS93-15-2MW178.23FormulaC11H14O2
CAS number
93-15-2
Molecular weight
178.23
Formula
C11H14O2
Solubility
DMSO ： 100 mg/mL (561·07 mM; Need ultrasonic); H2O ： < 0·1 mg/mL (insoluble)
InChIKey
ZYEMGPIYFIJGTP-UHFFFAOYSA-N
Catalogue number
GC38962
Brand
GLPBIO
Computed properties PubChem CID 7127 · XLogP 2.5 · TPSA 18.5 Ų · H-bond donors 0
XLogP
2.5
TPSA
18.5 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
13

SMILES COC1=C(C=C(C=C1)CC=C)OC

Computed descriptors from PubChem (CID 7127), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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