![4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 structure](/static/products/1816/18167-27-6.webp)
4-[3-(4-硝基苯氧基)丙氧基]苯甲腈
TL;DR: 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 (CAS 18167-27-6) is a chemical compound with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(4-硝基苯氧基)丙氧基]苯甲腈
4-[3-(4-nitrophenoxy)propoxy]benzonitrile
Also Known As: 4-[3-(4-nitrophenoxy)propoxy]benzonitrile
| Molecular Formula | C16H14N2O4 |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.09537 |
| Heavy Atoms | 22 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 18167-27-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)OCCCOC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | SUOUGIIJJSMPBA-UHFFFAOYSA-N |
Product Overview
4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 (CAS 18167-27-6), with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol. IUPAC: 4-[3-(4-nitrophenoxy)propoxy]benzonitrile.
Chemical Property Profile of 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈
Property Insights of 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈
The XLogP value of 3.2 indicates that 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈. Following Lipinski's Rule of Five, 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 has 0 hydrogen bond donor(s) and 5 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-[3-(4-硝基苯氧基)丙氧基]苯甲腈?
The CAS number of 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 is 18167-27-6.
What is the molecular formula of 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈?
The molecular formula of 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 is C16H14N2O4.
What is the molecular weight of 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈?
The molecular weight of 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 is 298.10 g/mol.
Where can I buy 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈?
You can request a quote for 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(4-硝基苯氧基)丙氧基]苯甲腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.