![[1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- structure](/static/products/6535/65355-37-5.webp)
[1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-
TL;DR: [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- (CAS 65355-37-5) is a chemical compound with molecular formula C20H35N and molecular weight 289.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-heptylcyclohexyl)cyclohexane-1-carbonitrile
Also Known As: 4-n-heptyl-4'-cyanobicyclohexane, KST-1A7502, (-)-17-Allylmorphinan-3-ol tartrate, trans,trans-4-Heptylbicyclohexyl-4-nitrile, 4-(4-heptylcyclohexyl)cyclohexane-1-carbonitrile
| Molecular Formula | C20H35N |
|---|---|
| Molecular Weight | 289.28 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 289.27695 |
| Heavy Atoms | 21 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 65355-37-5 |
|---|---|
| SMILES | CCCCCCCC1CCC(CC1)C2CCC(CC2)C#N |
| InChIKey | VNMUQCJCURWNKC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- (CAS 65355-37-5), with molecular formula C20H35N and molecular weight 289.28 g/mol. IUPAC: 4-(4-heptylcyclohexyl)cyclohexane-1-carbonitrile.
Chemical Property Profile of [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-
Property Insights of [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-
The XLogP value of 8.0 indicates that [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- 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 [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-?
The CAS number of [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- is 65355-37-5.
What is the molecular formula of [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-?
The molecular formula of [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- is C20H35N.
What is the molecular weight of [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-?
The molecular weight of [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- is 289.28 g/mol.
Where can I buy [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-?
You can request a quote for [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)-?
Yes, KEHONG BIO provides custom synthesis services for [1,1'-Bicyclohexyl]-4-carbonitrile, 4'-heptyl-, (trans,trans)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.