6-Phenoxynicotinaldehyde
TL;DR: 6-Phenoxynicotinaldehyde (CAS 173282-69-4) is a chemical compound with molecular formula C12H9NO2 and molecular weight 199.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenoxypyridine-3-carbaldehyde
Also Known As: 6-Phenoxynicotinaldehyde, 6-phenoxypyridine-3-carbaldehyde, 6-Phenoxypyridine-3-carboxaldehyde, 3-Pyridinecarboxaldehyde, 6-phenoxy-, 5-Formyl-2-phenoxypyridine
| Molecular Formula | C12H9NO2 |
|---|---|
| Molecular Weight | 199.06 g/mol |
| LogP | 2.6864 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.06332 |
| Heavy Atoms | 15 |
| Complexity | 436.93912 |
Chemical Identifiers
| CAS Number | 173282-69-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=NC=C(C=C2)C=O |
Product Overview
6-Phenoxynicotinaldehyde (CAS 173282-69-4), with molecular formula C12H9NO2 and molecular weight 199.06 g/mol. IUPAC: 6-phenoxypyridine-3-carbaldehyde.
Chemical Property Profile of 6-Phenoxynicotinaldehyde
Property Insights of 6-Phenoxynicotinaldehyde
The XLogP value of 2.6864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Phenoxynicotinaldehyde. With a topological polar surface area (TPSA) of 39.19 Ų, 6-Phenoxynicotinaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenoxynicotinaldehyde 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 6-Phenoxynicotinaldehyde?
The CAS number of 6-Phenoxynicotinaldehyde is 173282-69-4.
What is the molecular formula of 6-Phenoxynicotinaldehyde?
The molecular formula of 6-Phenoxynicotinaldehyde is C12H9NO2.
What is the molecular weight of 6-Phenoxynicotinaldehyde?
The molecular weight of 6-Phenoxynicotinaldehyde is 199.06 g/mol.
Where can I buy 6-Phenoxynicotinaldehyde?
You can request a quote for 6-Phenoxynicotinaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenoxynicotinaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenoxynicotinaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.