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Furaneol

CAT: 0013-GTR19169640-01Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19169640-01Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Furanones (HDMF) are key strawberry-like aroma compounds primarily found in Vitis labrusca grapes and hybrids. This small molecule is used in flavor research and in studies investigating aroma perception and biosynthesis pathways in both in vitro assays and food science applications.
CAS Number
3658-77-3
Product Name Alternative
Inhibit, Furaneol, HDMF, Inhibitor, 4-Hydroxy-2,5-dimethyl-3 (2H) furanone, Antibacterial
Field of Research
Infectious Disease & Virology, Metabolism Research
Purity
97.13% (May vary between batches)
Solubility
DMSO:100 mg/mL (780.46 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:4 mg/mL (31.22 mM)
Smiles
CC1OC (C) =C (O) C1=O
Molecular Formula
C6H8O3
Molecular Weight
128.13
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Furaneol

4-hydroxy-2,5-dimethylfuran-3-one is a member of the class of furans that is 2,5-dimethylfuran carrying additional oxo and hydroxy groups at positions 3 and 4 respectively. It has been found particularly in strawberries and other such fruits. It has a role as a flavouring agent, a fragrance and a plant metabolite. It is a member of furans, an enol and a cyclic ketone. It is a conjugate acid of a 4-hydroxy-2,5-dimethylfuran-3-olate.

CAS Number3658-77-3
PubChem CID19309
IUPAC Name4-hydroxy-2,5-dimethylfuran-3-one
Molecular FormulaC6H8O3
Molecular Weight128.13
XLogP0.7
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity181
SMILES
CC1C(=O)C(=C(O1)C)O
InChI
InChI=1S/C6H8O3/c1-3-5(7)6(8)4(2)9-3/h3,8H,1-2H3
InChIKey
INAXVXBDKKUCGI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Furaneol
CAS: 3658-77-3
CID: 19309
Formula: C6H8O3
MW: 128.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight128.13
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass128.047344113
Monoisotopic Mass128.047344113
Topological Polar Surface Area46.5 Ų
Heavy Atom Count9
Formal Charge0
Complexity181
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
BUP18052Furaneol
BIF0365Furaneol (13C6)
OR912574-01Furaneol acetate
HY-N7093R-01Furaneol (Standard)
OR912424-01Ethyl furaneol
AR-F11075-01Furaneol-13C2
GC3407-25mgFuraneol β-D-glucopyranoside
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