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31704-80-0

31704-80-0 structural image
Product Name: 3-(5-METHYL-2-FURYL)BUTYRALDEHYDE
Formula: C9H12O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless liquid; Vegetable, fruity aroma
Boiling Point 93.00 to 94.00 °C. @ 14.00 mm Hg
Solubility Insoluble in water; Soluble in oils
Density 1.006-1.012
Refractive Index 1.575-1.581

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Flame
Flammables
GHS02
GHS Hazard Statements H226:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P240:Ground/bond container and receiving equipment.
P241:Use explosion-proof electrical/ventilating/lighting/…/equipment.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

COMPUTED DESCRIPTORS

Molecular Weight 152.19 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 152.083729621 g/mol
Monoisotopic Mass 152.083729621 g/mol
Topological Polar Surface Area 30.2 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 134
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

3-(5-Methyl-2-furanyl)butanal is a heteroarene.