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Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate structure
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Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate

TL;DR: Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate (CAS 128612-43-1) is a chemical compound with molecular formula C14H12N2O4 and molecular weight 272.0797 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl 5-(5-methoxycarbonyl-3-pyridinyl)pyridine-3-carboxylate

Also Known As: Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate, Dimethyl 3,3'-Bipyridine-5,5'-dicarboxylate, dimethyl 3,3-bipyridine-5,5-dicarboxylate, methyl 5-(5-methoxycarbonylpyridin-3-yl)pyridine-3-carboxylate, Dimethyl 5,5'-bipyridine-3,3'-dicarboxylate

CAS Number
128612-43-1
Molecular Formula
C14H12N2O4
Molecular Weight
272.0797 g/mol
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Technical Specifications

Molecular FormulaC14H12N2O4
Molecular Weight272.0797 g/mol
XLogP1.1
Topological Polar Surface Area (TPSA)78.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds5
Exact Mass272.0797 Da
Heavy Atoms20
Complexity327.0
SMILESCOC(=O)C1=CN=CC(=C1)C2=CC(=CN=C2)C(=O)OC
InChIKeyFHLQRZZILYBCDV-UHFFFAOYSA-N

Chemical Property Profile of Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate

XLogP
1.1
TPSA (Topological Polar Surface Area)
78.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
5
Heavy Atoms
20
Complexity
327.0
Exact Mass
272.0797
Monoisotopic Mass
272.0797
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 Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate

The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate?

The CAS number of Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate is 128612-43-1.

What is the molecular formula of Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate?

The molecular formula of Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate is C14H12N2O4.

What is the molecular weight of Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate?

The molecular weight of Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate is 272.0797 g/mol.

Where can I buy Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate?

You can request a quote for Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate?

Yes, CoreyChem provides custom synthesis services for Dimethyl [3,3'-bipyridine]-5,5'-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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