1-(tert-Butoxy)naphthalene
TL;DR: 1-(tert-Butoxy)naphthalene (CAS 50337-75-2) is a chemical compound with molecular formula C14H16O and molecular weight 200.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-methylpropan-2-yl)oxy]naphthalene
Also Known As: 1-(tert-Butoxy)naphthalene, 1-t-butoxynaphthalene, 1-(t-Butoxy)naphthalene, 1-tert-Butoxynaphthalene, naphthol t-butyl ether
| Molecular Formula | C14H16O |
|---|---|
| Molecular Weight | 200.12 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.12012 |
| Heavy Atoms | 15 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 50337-75-2 |
|---|---|
| SMILES | CC(C)(C)OC1=CC=CC2=CC=CC=C21 |
| InChIKey | CQTPIJQVFIVEGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(tert-Butoxy)naphthalene (CAS 50337-75-2), with molecular formula C14H16O and molecular weight 200.12 g/mol. IUPAC: 1-[(2-methylpropan-2-yl)oxy]naphthalene.
Chemical Property Profile of 1-(tert-Butoxy)naphthalene
Property Insights of 1-(tert-Butoxy)naphthalene
The XLogP value of 4.6 indicates that 1-(tert-Butoxy)naphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-(tert-Butoxy)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(tert-Butoxy)naphthalene 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 1-(tert-Butoxy)naphthalene?
The CAS number of 1-(tert-Butoxy)naphthalene is 50337-75-2.
What is the molecular formula of 1-(tert-Butoxy)naphthalene?
The molecular formula of 1-(tert-Butoxy)naphthalene is C14H16O.
What is the molecular weight of 1-(tert-Butoxy)naphthalene?
The molecular weight of 1-(tert-Butoxy)naphthalene is 200.12 g/mol.
Where can I buy 1-(tert-Butoxy)naphthalene?
You can request a quote for 1-(tert-Butoxy)naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(tert-Butoxy)naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-(tert-Butoxy)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.