4-Pyridinecarboxaldehyde, O-hexyloxime
TL;DR: 4-Pyridinecarboxaldehyde, O-hexyloxime (CAS 72990-52-4) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-hexoxy-1-pyridin-4-ylmethanimine
Also Known As: 4-Pyridinecarboxaldehyde, O-hexyloxime, RefChem:1071509
| Molecular Formula | C12H18N2O |
|---|---|
| Molecular Weight | 206.14 g/mol |
| LogP | 3.0124 |
| Topological Polar Surface Area | 34.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 206.1419 |
| Heavy Atoms | 15 |
| Complexity | 272.21042 |
Chemical Identifiers
| CAS Number | 72990-52-4 |
|---|---|
| SMILES | CCCCCCO/N=C/C1=CC=NC=C1 |
Product Overview
4-Pyridinecarboxaldehyde, O-hexyloxime (CAS 72990-52-4), with molecular formula C12H18N2O and molecular weight 206.14 g/mol. IUPAC: (E)-N-hexoxy-1-pyridin-4-ylmethanimine.
Chemical Property Profile of 4-Pyridinecarboxaldehyde, O-hexyloxime
Property Insights of 4-Pyridinecarboxaldehyde, O-hexyloxime
The XLogP value of 3.0124 indicates that 4-Pyridinecarboxaldehyde, O-hexyloxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.48 Ų, 4-Pyridinecarboxaldehyde, O-hexyloxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pyridinecarboxaldehyde, O-hexyloxime 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 4-Pyridinecarboxaldehyde, O-hexyloxime?
The CAS number of 4-Pyridinecarboxaldehyde, O-hexyloxime is 72990-52-4.
What is the molecular formula of 4-Pyridinecarboxaldehyde, O-hexyloxime?
The molecular formula of 4-Pyridinecarboxaldehyde, O-hexyloxime is C12H18N2O.
What is the molecular weight of 4-Pyridinecarboxaldehyde, O-hexyloxime?
The molecular weight of 4-Pyridinecarboxaldehyde, O-hexyloxime is 206.14 g/mol.
Where can I buy 4-Pyridinecarboxaldehyde, O-hexyloxime?
You can request a quote for 4-Pyridinecarboxaldehyde, O-hexyloxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridinecarboxaldehyde, O-hexyloxime?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridinecarboxaldehyde, O-hexyloxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.