Ligustilide

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Catalog Number ACM4431010
Product Name Ligustilide
CAS Number 4431-01-0
Structure Ligustilide
IUPAC Name (3Z)-3-Butylidene-4,5-dihydro-2-benzofuran-1-one
Synonyms 3-[(Z)-Butylidene]-4,5-dihydrophthalide
Molecular Weight 190.24
Molecular Formula C12H14O2
Canonical SMILES CCCC=C1C2=C(C=CCC2)C(=O)O1
Inchi InChI=1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7-8H,2-4,6H2,1H3/b11-8-
InChIKey IQVQXVFMNOFTMU-FLIBITNWSA-N
Boiling Point 377.9±11.0 °C
Melting Point 297-298ºC
Flash Point 158.6ºC
Purity 98%+
Density 1.10±0.1 g/cm³
Appearance Oil
Physical State Liquid

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