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Dykellic Acid structure
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Dykellic Acid

TL;DR: Dykellic Acid (CAS 1097679-78-1) is a chemical compound with molecular formula C14H16O4 and molecular weight 248.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[5-methylidene-2-oxo-6-[(1E,3E)-penta-1,3-dienyl]pyran-3-yl]propanoic acid

Also Known As: Dykellic acid, HY-N14739, J1.171.369F, 3-[5-methylidene-2-oxo-6-[(1E,3E)-penta-1,3-dienyl]pyran-3-yl]propanoic Acid, 2-Oxo-5-methylene-6-[(1E,3E)-1,3-pentadienyl]-5,6-dihydro-2H-pyran-3-propionic acid

CAS Number
1097679-78-1
Molecular Formula
C14H16O4
Molecular Weight
248.10486 g/mol
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Technical Specifications

Molecular FormulaC14H16O4
Molecular Weight248.10486 g/mol
XLogP2.1
Topological Polar Surface Area (TPSA)63.6 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass248.10486 Da
Heavy Atoms18
Complexity441.0
SMILESC/C=C/C=C/C1C(=C)C=C(C(=O)O1)CCC(=O)O
InChIKeyXMBYWWHLSMXSPA-VNKDHWASSA-N

Chemical Property Profile of Dykellic Acid

XLogP
2.1
TPSA (Topological Polar Surface Area)
63.6
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
18
Complexity
441.0
Exact Mass
248.10486
Monoisotopic Mass
248.10486
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 Dykellic Acid

The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dykellic Acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dykellic Acid. Following Lipinski's Rule of Five, Dykellic Acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Dykellic Acid?

The CAS number of Dykellic Acid is 1097679-78-1.

What is the molecular formula of Dykellic Acid?

The molecular formula of Dykellic Acid is C14H16O4.

What is the molecular weight of Dykellic Acid?

The molecular weight of Dykellic Acid is 248.10486 g/mol.

Where can I buy Dykellic Acid?

You can request a quote for Dykellic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Dykellic Acid?

Yes, CoreyChem provides custom synthesis services for Dykellic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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