O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide
TL;DR: O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide (CAS 7401-93-6) is a chemical compound with molecular formula C13H19ClN2O3 and molecular weight 286.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,2-bis[ethyl(hydroxy)amino]ethyl]-4-chlorobenzaldehyde
Also Known As: O-Diethylaminoethyl-4-chlorobenzaldoxime-N-oxide, Sid 769219, 2-{2,2-bis[ethyl(hydroxy)amino]ethyl}-4-chlorobenzaldehyde, 2-[2,2-bis[ethyl(hydroxy)amino]ethyl]-4-chlorobenzaldehyde, Benzaldehyde, 4-chloro-, O-(2-(diethylamino)ethyl)oxime, N-oxide
| Molecular Formula | C13H19ClN2O3 |
|---|---|
| Molecular Weight | 286.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 286.10843 |
| Heavy Atoms | 19 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 7401-93-6 |
|---|---|
| SMILES | CCN(C(CC1=C(C=CC(=C1)Cl)C=O)N(CC)O)O |
| InChIKey | HINXUJZBZBXNJF-UHFFFAOYSA-N |
Product Overview
O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide (CAS 7401-93-6), with molecular formula C13H19ClN2O3 and molecular weight 286.11 g/mol. IUPAC: 2-[2,2-bis[ethyl(hydroxy)amino]ethyl]-4-chlorobenzaldehyde.
Chemical Property Profile of O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide
Property Insights of O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide. Following Lipinski's Rule of Five, O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide has 2 hydrogen bond donor(s) and 5 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 O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide?
The CAS number of O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide is 7401-93-6.
What is the molecular formula of O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide?
The molecular formula of O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide is C13H19ClN2O3.
What is the molecular weight of O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide?
The molecular weight of O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide is 286.11 g/mol.
Where can I buy O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide?
You can request a quote for O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide?
Yes, KEHONG BIO provides custom synthesis services for O-diethylaminoethyl-4-chlorobenzaldoxime-N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.