2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile
TL;DR: 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile (CAS 832674-41-6) is a chemical compound with molecular formula C10H8INO3 and molecular weight 316.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-formyl-2-iodo-6-methoxyphenoxy)acetonitrile
Also Known As: 2-(4-formyl-2-iodo-6-methoxyphenoxy)acetonitrile, (4-formyl-2-iodo-6-methoxyphenoxy)acetonitrile, 2-(4-formyl-2-iodo-6-methoxy-phenoxy)acetonitrile, 2-(4-formyl-2-iodo-6-methoxyphenoxy)ethanenitrile, Acetonitrile, 2-(4-formyl-2-iodo-6-methoxyphenoxy)
| Molecular Formula | C10H8INO3 |
|---|---|
| Molecular Weight | 316.95 g/mol |
| LogP | 2.01468 |
| Topological Polar Surface Area | 59.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.9549 |
| Heavy Atoms | 15 |
| Complexity | 411.86392 |
Chemical Identifiers
| CAS Number | 832674-41-6 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=O)I)OCC#N |
Product Overview
2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile (CAS 832674-41-6), with molecular formula C10H8INO3 and molecular weight 316.95 g/mol. IUPAC: 2-(4-formyl-2-iodo-6-methoxyphenoxy)acetonitrile.
Chemical Property Profile of 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile
Property Insights of 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile
The XLogP value of 2.01468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile. With a topological polar surface area (TPSA) of 59.32 Ų, 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile has 0 hydrogen bond donor(s) and 4 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 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile?
The CAS number of 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile is 832674-41-6.
What is the molecular formula of 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile?
The molecular formula of 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile is C10H8INO3.
What is the molecular weight of 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile?
The molecular weight of 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile is 316.95 g/mol.
Where can I buy 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile?
You can request a quote for 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Formyl-2-iodo-6-methoxyphenoxy)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.