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5-Methyl-3-Hexen-2-One
[CAS# 5166-53-0]

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Identification
Classification Flavors and spices >> Synthetic spice >> Ketone fragrance >> Decenone
Name 5-Methyl-3-Hexen-2-One
Synonyms 5-Methylhex-3-En-2-One; 187607_Aldrich; 3-Hexen-2-One, 5-Methyl-, Trans
Molecular Structure CAS#: 5166-53-0, 5-Methyl-3-Hexen-2-One
Molecular Formula C7H12O
Molecular Weight 112.17
CAS Registry Number 5166-53-0
EINECS 225-950-5
SMILES CC(\C=C\C(C)=O)C
InChI 1S/C7H12O/c1-6(2)4-5-7(3)8/h4-6H,1-3H3/b5-4+
InChIKey IYMKNYVCXUEFJE-SNAWJCMRSA-N
Properties
Density 0.83g/cm3 (Cal.)
Boiling point 150.674°C at 760 mmHg (Cal.)
Flash point 47.778°C (Cal.)
Refractive index 1.44 (Expl.)
Safety Data
Safety Description Danger: Flammable, Poison, irritates skin and eyes.
SDS Available
Market Analysis Reports
List of Reports Available for 5-Methyl-3-Hexen-2-One
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