Diethylcarbodiimide
TL;DR: Diethylcarbodiimide (CAS 693-29-8) is a chemical compound with molecular formula C5H10N2 and molecular weight 98.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-diethylmethanediimine
Also Known As: diethylcarbodiimide, N,N'-diethylcarbodiimide, 1,3-diethylcarbodiimide, N,N'-diethylmethanediimine, N,N -Diethylcarbodiimide
| Molecular Formula | C5H10N2 |
|---|---|
| Molecular Weight | 98.08 g/mol |
| LogP | 1.2001 |
| Topological Polar Surface Area | 24.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 98.0844 |
| Heavy Atoms | 7 |
| Complexity | 72.08094 |
Chemical Identifiers
| CAS Number | 693-29-8 |
|---|---|
| SMILES | CCN=C=NCC |
Product Overview
Diethylcarbodiimide (CAS 693-29-8), with molecular formula C5H10N2 and molecular weight 98.08 g/mol. IUPAC: N,N'-diethylmethanediimine.
Chemical Property Profile of Diethylcarbodiimide
Property Insights of Diethylcarbodiimide
The XLogP value of 1.2001 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethylcarbodiimide. With a topological polar surface area (TPSA) of 24.72 Ų, Diethylcarbodiimide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylcarbodiimide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethylcarbodiimide?
The CAS number of Diethylcarbodiimide is 693-29-8.
What is the molecular formula of Diethylcarbodiimide?
The molecular formula of Diethylcarbodiimide is C5H10N2.
What is the molecular weight of Diethylcarbodiimide?
The molecular weight of Diethylcarbodiimide is 98.08 g/mol.
Where can I buy Diethylcarbodiimide?
You can request a quote for Diethylcarbodiimide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethylcarbodiimide?
Yes, KEHONG BIO provides custom synthesis services for Diethylcarbodiimide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.