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104-27-8

104-27-8 structural image
Product Name: 1-(4-Methoxyphenyl)-1-penten-3-one
Formula: C12H14O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Boiling Point 278.00 °C. @ 760.00 mm Hg
Melting Point 61.3 - 61.9 °C
Solubility insoluble in water, soluble in organic solvents, oils

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H317:Sensitisation, Skin
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 190.24 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 190.099379685 g/mol
Monoisotopic Mass 190.099379685 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 200
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes