2-(2-Methylpropoxy)naphthalene
TL;DR: 2-(2-Methylpropoxy)naphthalene (CAS 2173-57-1) 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.
2-(2-methylpropoxy)naphthalene
Also Known As: 2-Isobutoxynaphthalene, Nerolin fragarol, 2-(2-Methylpropoxy)naphthalene, Fragarol, Isobutyl 2-naphthyl ether
| Molecular Formula | C14H16O |
|---|---|
| Molecular Weight | 200.12 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.12012 |
| Heavy Atoms | 15 |
| Complexity | 188.0 |
| Melting Point | 33 °C |
| Boiling Point | 308.00 to 309.00 °C. @ 760.00 mm Hg |
| Solubility | 0.00123 mg/mL |
Chemical Identifiers
| CAS Number | 2173-57-1 |
|---|---|
| SMILES | CC(C)COC1=CC2=CC=CC=C2C=C1 |
| InChIKey | XOHIHZHSDMWWMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Methylpropoxy)naphthalene (CAS 2173-57-1), with molecular formula C14H16O and molecular weight 200.12 g/mol. IUPAC: 2-(2-methylpropoxy)naphthalene.
Chemical Property Profile of 2-(2-Methylpropoxy)naphthalene
Property Insights of 2-(2-Methylpropoxy)naphthalene
The XLogP value of 4.8 indicates that 2-(2-Methylpropoxy)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, 2-(2-Methylpropoxy)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methylpropoxy)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 2-(2-Methylpropoxy)naphthalene?
The CAS number of 2-(2-Methylpropoxy)naphthalene is 2173-57-1.
What is the molecular formula of 2-(2-Methylpropoxy)naphthalene?
The molecular formula of 2-(2-Methylpropoxy)naphthalene is C14H16O.
What is the molecular weight of 2-(2-Methylpropoxy)naphthalene?
The molecular weight of 2-(2-Methylpropoxy)naphthalene is 200.12 g/mol.
Where can I buy 2-(2-Methylpropoxy)naphthalene?
You can request a quote for 2-(2-Methylpropoxy)naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methylpropoxy)naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methylpropoxy)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.