异烟醛O-异丙基肟
TL;DR: 异烟醛O-异丙基肟 (CAS 60833-42-3) is a chemical compound with molecular formula C9H12N2O and molecular weight 164.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异烟醛O-异丙基肟
N-propan-2-yloxy-1-pyridin-4-ylmethanimine
Also Known As: Isonicotinaldehyde O-isopropyloxime, isonicotinaldehydeO-isopropyloxime, N-propan-2-yloxy-1-pyridin-4-ylmethanimine, 4-Pyridinecarboxaldehyde,O-(1-methylethyl)oxime, N-[(Propan-2-yl)oxy]-1-(pyridin-4-yl)methanimine
| Molecular Formula | C9H12N2O |
|---|---|
| Molecular Weight | 164.09 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.09496 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 60833-42-3 |
|---|---|
| SMILES | CC(C)ON=CC1=CC=NC=C1 |
| InChIKey | GKIAWRQIOICTMY-UHFFFAOYSA-N |
Product Overview
异烟醛O-异丙基肟 (CAS 60833-42-3), with molecular formula C9H12N2O and molecular weight 164.09 g/mol. IUPAC: N-propan-2-yloxy-1-pyridin-4-ylmethanimine.
Chemical Property Profile of 异烟醛O-异丙基肟
Property Insights of 异烟醛O-异丙基肟
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 异烟醛O-异丙基肟. With a topological polar surface area (TPSA) of 34.5 Ų, 异烟醛O-异丙基肟 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异烟醛O-异丙基肟 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 异烟醛O-异丙基肟?
The CAS number of 异烟醛O-异丙基肟 is 60833-42-3.
What is the molecular formula of 异烟醛O-异丙基肟?
The molecular formula of 异烟醛O-异丙基肟 is C9H12N2O.
What is the molecular weight of 异烟醛O-异丙基肟?
The molecular weight of 异烟醛O-异丙基肟 is 164.09 g/mol.
Where can I buy 异烟醛O-异丙基肟?
You can request a quote for 异烟醛O-异丙基肟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异烟醛O-异丙基肟?
Yes, KEHONG BIO provides custom synthesis services for 异烟醛O-异丙基肟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.