Oxirane, 2-(2-(1-naphthalenyl)ethyl)-
TL;DR: Oxirane, 2-(2-(1-naphthalenyl)ethyl)- (CAS 111990-50-2) is a chemical compound with molecular formula C14H14O and molecular weight 198.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-naphthalen-1-ylethyl)oxirane
Also Known As: 1-Naphthylbutylene oxide, (2-(1-Naphthalenyl)ethyl)oxirane, Oxirane, 2-(2-(1-naphthalenyl)ethyl)-, 2-[2-(1-naphthalenyl)ethyl]Oxirane, 2-(2-(Naphthalen-1-yl)ethyl)oxirane
| Molecular Formula | C14H14O |
|---|---|
| Molecular Weight | 198.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.10446 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 111990-50-2 |
|---|---|
| SMILES | C1C(O1)CCC2=CC=CC3=CC=CC=C32 |
| InChIKey | RRNNFTXINDHWIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxirane, 2-(2-(1-naphthalenyl)ethyl)- (CAS 111990-50-2), with molecular formula C14H14O and molecular weight 198.10 g/mol. IUPAC: 2-(2-naphthalen-1-ylethyl)oxirane.
Chemical Property Profile of Oxirane, 2-(2-(1-naphthalenyl)ethyl)-
Property Insights of Oxirane, 2-(2-(1-naphthalenyl)ethyl)-
The XLogP value of 3.9 indicates that Oxirane, 2-(2-(1-naphthalenyl)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Oxirane, 2-(2-(1-naphthalenyl)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxirane, 2-(2-(1-naphthalenyl)ethyl)- 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 Oxirane, 2-(2-(1-naphthalenyl)ethyl)-?
The CAS number of Oxirane, 2-(2-(1-naphthalenyl)ethyl)- is 111990-50-2.
What is the molecular formula of Oxirane, 2-(2-(1-naphthalenyl)ethyl)-?
The molecular formula of Oxirane, 2-(2-(1-naphthalenyl)ethyl)- is C14H14O.
What is the molecular weight of Oxirane, 2-(2-(1-naphthalenyl)ethyl)-?
The molecular weight of Oxirane, 2-(2-(1-naphthalenyl)ethyl)- is 198.10 g/mol.
Where can I buy Oxirane, 2-(2-(1-naphthalenyl)ethyl)-?
You can request a quote for Oxirane, 2-(2-(1-naphthalenyl)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxirane, 2-(2-(1-naphthalenyl)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Oxirane, 2-(2-(1-naphthalenyl)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.