![4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile structure](/static/products/4985/498530-91-9.webp)
4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile
TL;DR: 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile (CAS 498530-91-9) is a chemical compound with molecular formula C24H35N and molecular weight 337.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-pentylcyclohexyl)cyclohexyl]benzonitrile
Also Known As: 4-[4-(4-pentylcyclohexyl)cyclohexyl]benzonitrile, 4-(4'-Pentyl-[1,1'-bi(cyclohexan)]-4-yl)benzonitrile, BENZO(a)PYRENE,6-BROMOMETHYL, BAS 00396051, 4-(1'-pentyl-4,4'-bicyclohexyl)-benzonitrile
| Molecular Formula | C24H35N |
|---|---|
| Molecular Weight | 337.28 g/mol |
| LogP | 7.21878 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.27695 |
| Heavy Atoms | 25 |
| Complexity | 536.4535 |
Chemical Identifiers
| CAS Number | 498530-91-9 |
|---|---|
| SMILES | CCCCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)C#N |
Product Overview
4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile (CAS 498530-91-9), with molecular formula C24H35N and molecular weight 337.28 g/mol. IUPAC: 4-[4-(4-pentylcyclohexyl)cyclohexyl]benzonitrile.
Chemical Property Profile of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile
Property Insights of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile
The XLogP value of 7.21878 indicates that 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile?
The CAS number of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile is 498530-91-9.
What is the molecular formula of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile?
The molecular formula of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile is C24H35N.
What is the molecular weight of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile?
The molecular weight of 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile is 337.28 g/mol.
Where can I buy 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile?
You can request a quote for 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(4-Pentylcyclohexyl)cyclohexyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.