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Diethyl malonimidate structure
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Diethyl malonimidate

TL;DR: Diethyl malonimidate (CAS 10344-69-1) is a chemical compound with molecular formula C7H16Cl2N2O2 and molecular weight 230.05888 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

diethyl propanediimidate;dihydrochloride

Also Known As: Diethyl malonimidate dihydrochloride, Diethyl malonimidate, diethyl malonimidate 2hcl, diethyl propanediimidate, diethyl propanediimidate;dihydrochloride

CAS Number
10344-69-1
Molecular Formula
C7H16Cl2N2O2
Molecular Weight
230.05888 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Organic Building Blocks (9 patents)

Technical Specifications

Molecular FormulaC7H16Cl2N2O2
Molecular Weight230.05888 g/mol
XLogP2.25
Topological Polar Surface Area (TPSA)66.2 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass230.05888 Da
Heavy Atoms13
Complexity129.0
SMILESCCOC(=N)CC(=N)OCC.Cl.Cl
InChIKeyTWUQXVGHXWRUBR-UHFFFAOYSA-N

Chemical Property Profile of Diethyl malonimidate

XLogP
2.25
TPSA (Topological Polar Surface Area)
66.2
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
13
Complexity
129.0
Exact Mass
230.05888
Monoisotopic Mass
230.05888
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 Diethyl malonimidate

The XLogP value of 2.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl malonimidate. The TPSA of 66.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl malonimidate. Following Lipinski's Rule of Five, Diethyl malonimidate has 4 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 Diethyl malonimidate?

The CAS number of Diethyl malonimidate is 10344-69-1.

What is the molecular formula of Diethyl malonimidate?

The molecular formula of Diethyl malonimidate is C7H16Cl2N2O2.

What is the molecular weight of Diethyl malonimidate?

The molecular weight of Diethyl malonimidate is 230.05888 g/mol.

Where can I buy Diethyl malonimidate?

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

Does CoreyChem offer custom synthesis for Diethyl malonimidate?

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

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