1-Ethylnaphthalene
TL;DR: 1-Ethylnaphthalene (CAS 1127-76-0) is a chemical compound with molecular formula C12H12 and molecular weight 156.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylnaphthalene
Also Known As: 1-ETHYLNAPHTHALENE, Naphthalene, 1-ethyl-, ETHYLNAPHTHALENE, 1-Ethylnaphtha, Naphthalene, ethyl-
| Molecular Formula | C12H12 |
|---|---|
| Molecular Weight | 156.09 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.0939 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 1127-76-0 |
|---|---|
| SMILES | CCC1=CC=CC2=CC=CC=C21 |
| InChIKey | ZMXIYERNXPIYFR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethylnaphthalene (CAS 1127-76-0), with molecular formula C12H12 and molecular weight 156.09 g/mol. IUPAC: 1-ethylnaphthalene.
Chemical Property Profile of 1-Ethylnaphthalene
Property Insights of 1-Ethylnaphthalene
The XLogP value of 4.4 indicates that 1-Ethylnaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Ethylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethylnaphthalene has 0 hydrogen bond donor(s) and 0 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-Ethylnaphthalene?
The CAS number of 1-Ethylnaphthalene is 1127-76-0.
What is the molecular formula of 1-Ethylnaphthalene?
The molecular formula of 1-Ethylnaphthalene is C12H12.
What is the molecular weight of 1-Ethylnaphthalene?
The molecular weight of 1-Ethylnaphthalene is 156.09 g/mol.
Where can I buy 1-Ethylnaphthalene?
You can request a quote for 1-Ethylnaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethylnaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.