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2,5-Furandimethanol

CAT: 0804-HY-W017782-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W017782-01Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
2,5-Furandimethanol (2,5-Bis (hydroxymethyl) furan) is a building block for the enzymatic synthesis of bio-based polyesters. 2,5-Furandimethanol is also a metabolite of Phellinus linteus. 2,5-Furandimethanol affects leukemia. 2,5-Furandimethanol can be used in fungal infection research[1][2].
CAS Number
1883-75-6
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Biochemical Assay Reagents; Endogenous Metabolite; Fungal
Type
Natural Products
Related Pathways
Anti-infection; Metabolic Enzyme/Protease; Others
Field of Research
Cancer; Infection
Assay Protocol
https://www.medchemexpress.com/2-5-furandimethanol.html
Purity
99.89
Solubility
DMSO : 50 mg/mL (ultrasonic) |H2O : 100 mg/mL (ultrasonic)
Smiles
OCC1=CC=C(CO)O1
Molecular Formula
C6H8O3
Molecular Weight
128.13
Precautions
H302, H315, H319, H335
References & Citations
[1]Schneider G, et al. Xylaramide, a new antifungal compound, and other secondary metabolites from Xylaria longipes. Z Naturforsch C J Biosci. 1996 Nov-Dec;51 (11-12) :802-6. |[2]Jiang Y, et al. Enzymatic synthesis of biobased polyesters using 2,5-bis (hydroxymethyl) furan as the building block. Biomacromolecules. 2014 Jul 14;15 (7) :2482-93.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C (Powder, stored under nitrogen)
Scientific Category
Natural Products
Clinical Information
No Development Reported
Isoform
Microbial Metabolite

Chemical Information

2,5-Furandimethanol

2,5-furandimethanol is a furan carrying two hydroxymethyl substituents at the 2- and 5-positions. It is a diol and a member of furans.

CAS Number1883-75-6
PubChem CID74663
IUPAC Name[5-(hydroxymethyl)furan-2-yl]methanol
Molecular FormulaC6H8O3
Molecular Weight128.13
XLogP-0.7
Topological Polar Surface Area53.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity74
SMILES
C1=C(OC(=C1)CO)CO
InChI
InChI=1S/C6H8O3/c7-3-5-1-2-6(4-8)9-5/h1-2,7-8H,3-4H2
InChIKey
DSLRVRBSNLHVBH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Furandimethanol
CAS: 1883-75-6
CID: 74663
Formula: C6H8O3
MW: 128.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight128.13
XLogP3-0.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass128.047344113
Monoisotopic Mass128.047344113
Topological Polar Surface Area53.6 Ų
Heavy Atom Count9
Formal Charge0
Complexity74.4
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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