1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene
TL;DR: 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene (CAS 42969-71-1) is a chemical compound with molecular formula C13H9BrO and molecular weight 259.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-prop-2-ynoxynaphthalene
Also Known As: 1-bromo-2-prop-2-ynoxynaphthalene, 1-bromo-2-(prop-2-yn-1-yloxy)naphthalene, 1-Bromo-2-prop-2-ynyloxy-naphthalene
| Molecular Formula | C13H9BrO |
|---|---|
| Molecular Weight | 259.98 g/mol |
| LogP | 3.6143 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.98367 |
| Heavy Atoms | 15 |
| Complexity | 525.53723 |
Chemical Identifiers
| CAS Number | 42969-71-1 |
|---|---|
| SMILES | C#CCOC1=C(C2=CC=CC=C2C=C1)Br |
Product Overview
1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene (CAS 42969-71-1), with molecular formula C13H9BrO and molecular weight 259.98 g/mol. IUPAC: 1-bromo-2-prop-2-ynoxynaphthalene.
Chemical Property Profile of 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene
Property Insights of 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene
The XLogP value of 3.6143 indicates that 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-(prop-2-yn-1-yloxy)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 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene?
The CAS number of 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene is 42969-71-1.
What is the molecular formula of 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene?
The molecular formula of 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene is C13H9BrO.
What is the molecular weight of 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene?
The molecular weight of 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene is 259.98 g/mol.
Where can I buy 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene?
You can request a quote for 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-(prop-2-yn-1-yloxy)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.