![4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde structure](/static/products/6561/65611-34-9.webp)
4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde
TL;DR: 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde (CAS 65611-34-9) is a chemical compound with molecular formula C11H12Cl3NO and molecular weight 279.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(2-chloroethyl)amino]-2-chlorobenzaldehyde
Also Known As: n-decyl trichloroacetate, NCIOpen2_003752, 4-[bis(2-chloroethyl)amino]-2-chlorobenzaldehyde
| Molecular Formula | C11H12Cl3NO |
|---|---|
| Molecular Weight | 279.00 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 278.99844 |
| Heavy Atoms | 16 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 65611-34-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1N(CCCl)CCCl)Cl)C=O |
| InChIKey | HKSLIEMSMQTDPW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde (CAS 65611-34-9), with molecular formula C11H12Cl3NO and molecular weight 279.00 g/mol. IUPAC: 4-[bis(2-chloroethyl)amino]-2-chlorobenzaldehyde.
Chemical Property Profile of 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde
Property Insights of 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde
The XLogP value of 3.3 indicates that 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde 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 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde?
The CAS number of 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde is 65611-34-9.
What is the molecular formula of 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde?
The molecular formula of 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde is C11H12Cl3NO.
What is the molecular weight of 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde?
The molecular weight of 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde is 279.00 g/mol.
Where can I buy 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde?
You can request a quote for 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-[Bis(2-chloroethyl)amino]-2-chlorobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.