N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide
TL;DR: N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide (CAS 54139-57-0) is a chemical compound with molecular formula C12H14Cl3NO2 and molecular weight 309.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide
Also Known As: N,N-bis -2- acetamide, N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide, Acetamide, N,N-bis(2-chloroethyl)-2-(4-chlorophenoxy)-, Acetamide,N,N-bis(2-chloroethyl)-2-(4-chlorophenoxy)
| Molecular Formula | C12H14Cl3NO2 |
|---|---|
| Molecular Weight | 309.01 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 309.009 |
| Heavy Atoms | 18 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 54139-57-0 |
|---|---|
| SMILES | C1=CC(=CC=C1OCC(=O)N(CCCl)CCCl)Cl |
| InChIKey | FKOWMCIRROPLNY-UHFFFAOYSA-N |
Product Overview
N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide (CAS 54139-57-0), with molecular formula C12H14Cl3NO2 and molecular weight 309.01 g/mol. IUPAC: N,N-bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide.
Chemical Property Profile of N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide
Property Insights of N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide
The XLogP value of 3.2 indicates that N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide 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 N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide?
The CAS number of N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide is 54139-57-0.
What is the molecular formula of N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide?
The molecular formula of N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide is C12H14Cl3NO2.
What is the molecular weight of N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide?
The molecular weight of N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide is 309.01 g/mol.
Where can I buy N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide?
You can request a quote for N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(2-chloroethyl)-2-(4-chlorophenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.