2-chloro-N,N-bis(2-cyanoethyl)acetamide
TL;DR: 2-chloro-N,N-bis(2-cyanoethyl)acetamide (CAS 26530-34-7) is a chemical compound with molecular formula C8H10ClN3O and molecular weight 199.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N,N-bis(2-cyanoethyl)acetamide
Also Known As: 2-chloro-N,N-bis(2-cyanoethyl)acetamide, Acetamide, 2-chloro-N,N-bis(2-cyanoethyl)-, 2-Chloro-N,N-bis- -acetamide, Acetamide,2-chloro-N,N-bis(2-cyanoethyl)-, 2-Chloro-N,N-bis-(2-cyano-ethyl)-acetamide
| Molecular Formula | C8H10ClN3O |
|---|---|
| Molecular Weight | 199.05 g/mol |
| LogP | 0.88116 |
| Topological Polar Surface Area | 67.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.05124 |
| Heavy Atoms | 13 |
| Complexity | 222.75415 |
Chemical Identifiers
| CAS Number | 26530-34-7 |
|---|---|
| SMILES | C(CN(CCC#N)C(=O)CCl)C#N |
Product Overview
2-chloro-N,N-bis(2-cyanoethyl)acetamide (CAS 26530-34-7), with molecular formula C8H10ClN3O and molecular weight 199.05 g/mol. IUPAC: 2-chloro-N,N-bis(2-cyanoethyl)acetamide.
Chemical Property Profile of 2-chloro-N,N-bis(2-cyanoethyl)acetamide
Property Insights of 2-chloro-N,N-bis(2-cyanoethyl)acetamide
The XLogP value of 0.88116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N,N-bis(2-cyanoethyl)acetamide. The TPSA of 67.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N,N-bis(2-cyanoethyl)acetamide. Following Lipinski's Rule of Five, 2-chloro-N,N-bis(2-cyanoethyl)acetamide has 0 hydrogen bond donor(s) and 3 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 2-chloro-N,N-bis(2-cyanoethyl)acetamide?
The CAS number of 2-chloro-N,N-bis(2-cyanoethyl)acetamide is 26530-34-7.
What is the molecular formula of 2-chloro-N,N-bis(2-cyanoethyl)acetamide?
The molecular formula of 2-chloro-N,N-bis(2-cyanoethyl)acetamide is C8H10ClN3O.
What is the molecular weight of 2-chloro-N,N-bis(2-cyanoethyl)acetamide?
The molecular weight of 2-chloro-N,N-bis(2-cyanoethyl)acetamide is 199.05 g/mol.
Where can I buy 2-chloro-N,N-bis(2-cyanoethyl)acetamide?
You can request a quote for 2-chloro-N,N-bis(2-cyanoethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N,N-bis(2-cyanoethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N,N-bis(2-cyanoethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.