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698-10-2

698-10-2 Structure

698-10-2 Structure
IdentificationMore
[Name]

3-Hydroxy-4-methyl-5-ethyl-2(5H)furanone
[CAS]

698-10-2
[Synonyms]

3-hydroxy-4-methyl-5-ethyl-2(5h)furanone
3-HYDROXY-4-METHYL-5-ETHYL-2-FURANONE
5-ETHYL-3-HYDROXY-4-METHYL-2(5H)-FURANONE
5-ETHYL-3-HYDROXY-4-METHYL-5H-FURAN-2-ONE
5-ETHYL-4-METHYL-3-HYDROXYFURANONE
Emoxyfurone
ETHYL FENUGREEK LACTONE
FEMA 3153
MAPLE FURANONE
2(5H)-Furanone, 5-ethyl-3-hydroxy-4-methyl-
2-Hexenoic acid, 2,4-dihydroxy-3-methyl-, gamma-lactone
4-Methyl-5-ethyl-3-hydroxyfuranone
5-ethyl-3-hydroxy-4-methyl-2(5h)-furanon
Abhexone
Ethylfenugrecklactone
5-ethyl-3-hydroxy-4-methylfuran-2(5H)-one
abhexone,5-ethyl-3-hydroxy-4-methyl-2(5H)-furanone
2,4-DIHYDROXY-3-METHYL-HEX-2-ENOICACID-4-LACTONE
2-ETHYL-3-METHYL-4-HYDROXYDIHYDRO-(2,5)-FURAN-5-ONE
5-ETHYL-3-HYDROXY-4-METHYL-2(5H)-FURANONE 96+%
[EINECS(EC#)]

211-811-6
[Molecular Formula]

C7H10O3
[MDL Number]

MFCD00036673
[Molecular Weight]

142.15
[MOL File]

698-10-2.mol
Chemical PropertiesBack Directory
[Appearance]

light yellow liqui
[Melting point ]

31-35 °C(lit.)
[Boiling point ]

83-86 °C0.5 mm Hg(lit.)
[density ]

1.1643 (rough estimate)
[FEMA ]

3153
[refractive index ]

n20/D 1.49(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

powder to lump to clear liquid
[pka]

9.28±0.40(Predicted)
[color ]

White or Colorless to Yellow
[Odor]

at 0.01 % in dipropylene glycol. sweet fruity caramellic maple fenugreek brown sugar nutty chicory praline butterscotch
[Odor Type]

caramellic
[FreezingPoint ]

25.0 to 29.0 ℃
[JECFA Number]

222
[Stability:]

Hygroscopic
[InChIKey]

IUFQZPBIRYFPFD-UHFFFAOYSA-N
[LogP]

0.09
[CAS DataBase Reference]

698-10-2(CAS DataBase Reference)
[NIST Chemistry Reference]

2(5H)-furanone, 5-ethyl-3-hydroxy-4-methyl-(698-10-2)
[EPA Substance Registry System]

698-10-2(EPA Substance)
Safety DataBack Directory
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[RIDADR ]

UN 3335
[WGK Germany ]

3
[HS Code ]

29322090
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Hydroxy-4-methyl-5-ethyl-2(5H)furanone(698-10-2).msds
Hazard InformationBack Directory
[Chemical Properties]

5-Ethyl-3-hydroxy-4-methyl-2(5H)-furanone has a sweet, maple, caramel odor.
[Chemical Properties]

Abhexone has been found in, for example, lovage and roasted coffee. It has a bouillon-like, coffee and lovage aroma, depending on its concentration. It can be prepared starting from alkyl 2-oxobutanoate either by self-condensation followed subsequently by decarbomethoxylation or by condensation with propionaldehyde and subsequent cyclization . Alkyl 2-oxobutanoate is available from acrylaldehyde and sodium cyanide via alkyl 2-hydroxy-3-butenoate or by reaction of dialkyloxalate with ethyl magnesium bromide . It is used for aromatization of food.
[Chemical Properties]

light yellow liqui
[Occurrence]

Reported found in coffee.
[Uses]

5-Ethyl-3-hydroxy-4-methyl-2(5H)-furanone is an odorant found in grape stems, Jura Flor-Sherry wines and roasted arabica coffee.
[Definition]

ChEBI: 5-ethyl-3-hydroxy-4-methyl-2(5H)-furanone is a butenolide. It has a role as a metabolite.
[Taste threshold values]

Taste characteristics at 50 ppm: sweet, fruity with brown maple note.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Hydroxy-4-methyl-5-ethyl-2(5H)furanone(698-10-2)1HNMR
3-Hydroxy-4-methyl-5-ethyl-2(5H)furanone(698-10-2)IR
3-Hydroxy-4-methyl-5-ethyl-2(5H)furanone(698-10-2)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

698-10-2(sigmaaldrich)
[TCI AMERICA]

5-Ethyl-3-hydroxy-4-methyl-2(5H)-furanone,>97.0%(GC)(698-10-2)
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