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2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione structure
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2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione

TL;DR: 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione (CAS 109610-93-7) is a chemical compound with molecular formula C12H12O5 and molecular weight 236.06847 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,2-dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione

Also Known As: Maybridge1_007587, 2,2-dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione, isopropylidene p-nitrobenzalmalonate, 2,2-dimethyl-5-[(5-methyl-2-furyl)methylene]-1,3-dioxane-4,6-dione, J1.985.731J

CAS Number
109610-93-7
Molecular Formula
C12H12O5
Molecular Weight
236.06847 g/mol
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Technical Specifications

Molecular FormulaC12H12O5
Molecular Weight236.06847 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)65.7 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass236.06847 Da
Heavy Atoms17
Complexity360.0
SMILESCC1=CC=C(O1)C=C2C(=O)OC(OC2=O)(C)C
InChIKeyGHGSQHBSHYQLED-UHFFFAOYSA-N

Chemical Property Profile of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione

XLogP
2.3
TPSA (Topological Polar Surface Area)
65.7
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
17
Complexity
360.0
Exact Mass
236.06847
Monoisotopic Mass
236.06847
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione. Following Lipinski's Rule of Five, 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione?

The CAS number of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione is 109610-93-7.

What is the molecular formula of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione?

The molecular formula of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione is C12H12O5.

What is the molecular weight of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione?

The molecular weight of 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione is 236.06847 g/mol.

Where can I buy 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione?

You can request a quote for 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione?

Yes, CoreyChem provides custom synthesis services for 2,2-Dimethyl-5-[(5-methylfuran-2-yl)methylidene]-1,3-dioxane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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