6-Cyano-1,2,3,4-tetrahydronaphthalene
TL;DR: 6-Cyano-1,2,3,4-tetrahydronaphthalene (CAS 20665-63-8) is a chemical compound with molecular formula C11H11N and molecular weight 157.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7,8-tetrahydronaphthalene-2-carbonitrile
Also Known As: 6-Cyanotetralin, 5,6,7,8-tetrahydronaphthalene-2-carbonitrile, 6-Cyano-1,2,3,4-tetrahydronaphthalene, starbld0039697, Tetrahydrofuran-2,2,5,5-d4
| Molecular Formula | C11H11N |
|---|---|
| Molecular Weight | 157.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.08914 |
| Heavy Atoms | 12 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 20665-63-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2)C#N |
| InChIKey | TWDAXWPAXMGRAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Cyano-1,2,3,4-tetrahydronaphthalene (CAS 20665-63-8), with molecular formula C11H11N and molecular weight 157.09 g/mol. IUPAC: 5,6,7,8-tetrahydronaphthalene-2-carbonitrile.
Chemical Property Profile of 6-Cyano-1,2,3,4-tetrahydronaphthalene
Property Insights of 6-Cyano-1,2,3,4-tetrahydronaphthalene
The XLogP value of 3.0 indicates that 6-Cyano-1,2,3,4-tetrahydronaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 6-Cyano-1,2,3,4-tetrahydronaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Cyano-1,2,3,4-tetrahydronaphthalene has 0 hydrogen bond donor(s) and 1 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 6-Cyano-1,2,3,4-tetrahydronaphthalene?
The CAS number of 6-Cyano-1,2,3,4-tetrahydronaphthalene is 20665-63-8.
What is the molecular formula of 6-Cyano-1,2,3,4-tetrahydronaphthalene?
The molecular formula of 6-Cyano-1,2,3,4-tetrahydronaphthalene is C11H11N.
What is the molecular weight of 6-Cyano-1,2,3,4-tetrahydronaphthalene?
The molecular weight of 6-Cyano-1,2,3,4-tetrahydronaphthalene is 157.09 g/mol.
Where can I buy 6-Cyano-1,2,3,4-tetrahydronaphthalene?
You can request a quote for 6-Cyano-1,2,3,4-tetrahydronaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Cyano-1,2,3,4-tetrahydronaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 6-Cyano-1,2,3,4-tetrahydronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.