1-Ethynylnaphthalene
TL;DR: 1-Ethynylnaphthalene (CAS 15727-65-8) is a chemical compound with molecular formula C12H8 and molecular weight 152.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethynylnaphthalene
Also Known As: 1-Ethynylnaphthalene, Naphthalene, 1-ethynyl-, naphthylacetylene, 1-naphthylethyne, ethynylnaphthalene
| Molecular Formula | C12H8 |
|---|---|
| Molecular Weight | 152.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.0626 |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 15727-65-8 |
|---|---|
| SMILES | C#CC1=CC=CC2=CC=CC=C21 |
| InChIKey | MCZUXEWWARACSP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethynylnaphthalene (CAS 15727-65-8), with molecular formula C12H8 and molecular weight 152.06 g/mol. IUPAC: 1-ethynylnaphthalene.
Chemical Property Profile of 1-Ethynylnaphthalene
Property Insights of 1-Ethynylnaphthalene
The XLogP value of 3.8 indicates that 1-Ethynylnaphthalene 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-Ethynylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethynylnaphthalene 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-Ethynylnaphthalene?
The CAS number of 1-Ethynylnaphthalene is 15727-65-8.
What is the molecular formula of 1-Ethynylnaphthalene?
The molecular formula of 1-Ethynylnaphthalene is C12H8.
What is the molecular weight of 1-Ethynylnaphthalene?
The molecular weight of 1-Ethynylnaphthalene is 152.06 g/mol.
Where can I buy 1-Ethynylnaphthalene?
You can request a quote for 1-Ethynylnaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethynylnaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethynylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.