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Estragole
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Estragole

CAS 140-67-0
Structure
Synonyms 4-Allylanisole
IUPAC Name 1-Methoxy-4-prop-2-enylbenzene
Molecular Weight 148.2
Canonical SMILES COC1=CC=C(C=C1)CC=C
InChI InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3
InChI Key ZFMSMUAANRJZFM-UHFFFAOYSA-N
Boiling Point 215-216 °C
Melting Point 25 °C
Flash Point 178 °F
Purity 95%+
Density 0.965 g/mL at 25 °C(lit.)
Solubility Insoluble in water; soluble in alcohols
Exact Mass 148.088815002
Monoisotopic Mass 148.088815002
Physical State Liquid
Refractive Index n20/D 1.521(lit.)
Storage Conditions Dry place,2-8 °C
Topological Polar Surface Area 9.2 Ų

For Research Use Only. Not for use in diagnostic or therapeutic procedures.