1-萘基炔丙基醚
TL;DR: 1-萘基炔丙基醚 (CAS 18542-45-5) is a chemical compound with molecular formula C13H10O and molecular weight 182.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-萘基炔丙基醚
1-prop-2-ynoxynaphthalene
Also Known As: 1-(2-Propynyloxy)naphthalene, 1-prop-2-ynoxynaphthalene, naphthyl propargyl ether, propargyl naphthyl ether, 1-(2-Propyn-1-yloxy)naphthalene
| Molecular Formula | C13H10O |
|---|---|
| Molecular Weight | 182.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.07317 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 18542-45-5 |
|---|---|
| SMILES | C#CCOC1=CC=CC2=CC=CC=C21 |
| InChIKey | SQUJYDFTMPTTLT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-萘基炔丙基醚 (CAS 18542-45-5), with molecular formula C13H10O and molecular weight 182.07 g/mol. IUPAC: 1-prop-2-ynoxynaphthalene.
Chemical Property Profile of 1-萘基炔丙基醚
Property Insights of 1-萘基炔丙基醚
The XLogP value of 3.3 indicates that 1-萘基炔丙基醚 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-萘基炔丙基醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-萘基炔丙基醚 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-萘基炔丙基醚?
The CAS number of 1-萘基炔丙基醚 is 18542-45-5.
What is the molecular formula of 1-萘基炔丙基醚?
The molecular formula of 1-萘基炔丙基醚 is C13H10O.
What is the molecular weight of 1-萘基炔丙基醚?
The molecular weight of 1-萘基炔丙基醚 is 182.07 g/mol.
Where can I buy 1-萘基炔丙基醚?
You can request a quote for 1-萘基炔丙基醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-萘基炔丙基醚?
Yes, KEHONG BIO provides custom synthesis services for 1-萘基炔丙基醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.