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1703-52-2

1703-52-2 structural image
Product Name: 2-ETHYL-5-METHYL FURAN
Formula: C7H10O
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CHEMICAL AND PHYSICAL PROPERTIES

Boiling Point 118.00 to 119.00 °C. @ 760.00 mm Hg
Kovats Retention Index 791 797 791 789
Chemical Classes Other Classes -> Ethers, Other

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H225:Flammable liquids
H302:Acute toxicity,oral
H332:Acute toxicity,inhalation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.

COMPUTED DESCRIPTORS

Molecular Weight 110.15 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 110.073164938 g/mol
Monoisotopic Mass 110.073164938 g/mol
Topological Polar Surface Area 13.1 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 70.8
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

2-ethyl-5-methylfuran is a member of the class of furans that is furan in which the hydrogens at positions 2 and 5 are replaced by ethyl and methyl groups, respectively. It has a role as a flavouring agent, a human urinary metabolite, a plant metabolite, a fungal metabolite and a mouse metabolite.