isonicotinaldehyde O-isopentyloxime
TL;DR: isonicotinaldehyde O-isopentyloxime (CAS 67342-76-1) is a chemical compound with molecular formula C11H16N2O and molecular weight 192.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methylbutoxy)-1-pyridin-4-ylmethanimine
Also Known As: isonicotinaldehyde O-isopentyloxime, 4-Pyridinealdoxime O-Isoamyl Ether, N-(3-methylbutoxy)-1-pyridin-4-ylmethanimine
| Molecular Formula | C11H16N2O |
|---|---|
| Molecular Weight | 192.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.12627 |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 67342-76-1 |
|---|---|
| SMILES | CC(C)CCON=CC1=CC=NC=C1 |
| InChIKey | CRGKERCSBLXMPN-UHFFFAOYSA-N |
Product Overview
isonicotinaldehyde O-isopentyloxime (CAS 67342-76-1), with molecular formula C11H16N2O and molecular weight 192.13 g/mol. IUPAC: N-(3-methylbutoxy)-1-pyridin-4-ylmethanimine.
Chemical Property Profile of isonicotinaldehyde O-isopentyloxime
Property Insights of isonicotinaldehyde O-isopentyloxime
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for isonicotinaldehyde O-isopentyloxime. With a topological polar surface area (TPSA) of 34.5 Ų, isonicotinaldehyde O-isopentyloxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, isonicotinaldehyde O-isopentyloxime 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 isonicotinaldehyde O-isopentyloxime?
The CAS number of isonicotinaldehyde O-isopentyloxime is 67342-76-1.
What is the molecular formula of isonicotinaldehyde O-isopentyloxime?
The molecular formula of isonicotinaldehyde O-isopentyloxime is C11H16N2O.
What is the molecular weight of isonicotinaldehyde O-isopentyloxime?
The molecular weight of isonicotinaldehyde O-isopentyloxime is 192.13 g/mol.
Where can I buy isonicotinaldehyde O-isopentyloxime?
You can request a quote for isonicotinaldehyde O-isopentyloxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for isonicotinaldehyde O-isopentyloxime?
Yes, KEHONG BIO provides custom synthesis services for isonicotinaldehyde O-isopentyloxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.