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Catalog Number ACM122485
CAS 122-48-5
Structure {[CurrentData.Name]}
IUPAC Name 4-(4-Hydroxy-3-methoxyphenyl)butan-2-one
Synonyms Vanillylacetone
Molecular Weight 194.23
Molecular Formula C11H14O3
Canonical SMILES CC(=O)CCC1=CC(=C(C=C1)O)OC
Inchi InChI=1S/C11H14O3/c1-8(12)3-4-9-5-6-10(13)11(7-9)14-2/h5-7,13H,3-4H2,1-2H3
InChIKey OJYLAHXKWMRDGS-UHFFFAOYSA-N
Boiling Point 141 °C
Melting Point 40-41 °C
Flash Point >230 °F
Purity 98%+
Density 1.14 g/mL at 25 °C(lit.)
Physical State Crystalline powder
Refractive Index n20/D 1.541(lit.)

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