4-氰基-4'-戊氧基联苯
TL;DR: 4-氰基-4'-戊氧基联苯 (CAS 52364-71-3) is a chemical compound with molecular formula C18H19NO and molecular weight 265.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氰基-4'-戊氧基联苯
4-(4-pentoxyphenyl)benzonitrile
Also Known As: 4'-Pentyloxy-[1,1'-Biphenyl]-4-carbonitrile, 4-Pentyloxy-4'-cyanobiphenyl, 5OCB, 4-Cyano-4'-pentyloxybiphenyl, 4-Amyloxycyanodiphenyl
| Molecular Formula | C18H19NO |
|---|---|
| Molecular Weight | 265.15 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.14667 |
| Heavy Atoms | 20 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 52364-71-3 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N |
| InChIKey | RDISTOCQRJJICR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氰基-4'-戊氧基联苯 (CAS 52364-71-3), with molecular formula C18H19NO and molecular weight 265.15 g/mol. IUPAC: 4-(4-pentoxyphenyl)benzonitrile.
Chemical Property Profile of 4-氰基-4'-戊氧基联苯
Property Insights of 4-氰基-4'-戊氧基联苯
The XLogP value of 5.0 indicates that 4-氰基-4'-戊氧基联苯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.0 Ų, 4-氰基-4'-戊氧基联苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氰基-4'-戊氧基联苯 has 0 hydrogen bond donor(s) and 2 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-氰基-4'-戊氧基联苯?
The CAS number of 4-氰基-4'-戊氧基联苯 is 52364-71-3.
What is the molecular formula of 4-氰基-4'-戊氧基联苯?
The molecular formula of 4-氰基-4'-戊氧基联苯 is C18H19NO.
What is the molecular weight of 4-氰基-4'-戊氧基联苯?
The molecular weight of 4-氰基-4'-戊氧基联苯 is 265.15 g/mol.
Where can I buy 4-氰基-4'-戊氧基联苯?
You can request a quote for 4-氰基-4'-戊氧基联苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氰基-4'-戊氧基联苯?
Yes, KEHONG BIO provides custom synthesis services for 4-氰基-4'-戊氧基联苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.