2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-
TL;DR: 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- (CAS 58243-87-1) is a chemical compound with molecular formula C17H23N and molecular weight 241.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonitrile
Also Known As: 1,1,4,4-Tetramethyl-6-ethyl-7-cyanotetralin, 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-, 3-Ethyl-5,5,8,8-Tetramethyl-5,6,7,8-Tetrahydro-Naphthalene-2-Carbonitrile, 3-ethyl-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbonitrile, 3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonitrile
| Molecular Formula | C17H23N |
|---|---|
| Molecular Weight | 241.18 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.18304 |
| Heavy Atoms | 18 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 58243-87-1 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1C#N)C(CCC2(C)C)(C)C |
| InChIKey | LELXPNKVSBCRLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- (CAS 58243-87-1), with molecular formula C17H23N and molecular weight 241.18 g/mol. IUPAC: 3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonitrile.
Chemical Property Profile of 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-
Property Insights of 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-
The XLogP value of 5.6 indicates that 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- 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 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-?
The CAS number of 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- is 58243-87-1.
What is the molecular formula of 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-?
The molecular formula of 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- is C17H23N.
What is the molecular weight of 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-?
The molecular weight of 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- is 241.18 g/mol.
Where can I buy 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-?
You can request a quote for 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthalenecarbonitrile, 3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.