(Prop-2-ynyloxy)benzene
TL;DR: (Prop-2-ynyloxy)benzene (CAS 13610-02-1) is a chemical compound with molecular formula C9H8O and molecular weight 132.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-ynoxybenzene
Also Known As: Phenyl propargyl ether, prop-2-ynoxybenzene, (Prop-2-ynyloxy)benzene, (prop-2-yn-1-yloxy)benzene, Phenyl 2-propynyl ether
| Molecular Formula | C9H8O |
|---|---|
| Molecular Weight | 132.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 132.05751 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 13610-02-1 |
|---|---|
| SMILES | C#CCOC1=CC=CC=C1 |
| InChIKey | AIQRJSXKXVZCJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(Prop-2-ynyloxy)benzene (CAS 13610-02-1), with molecular formula C9H8O and molecular weight 132.06 g/mol. IUPAC: prop-2-ynoxybenzene.
Chemical Property Profile of (Prop-2-ynyloxy)benzene
Property Insights of (Prop-2-ynyloxy)benzene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Prop-2-ynyloxy)benzene. With a topological polar surface area (TPSA) of 9.2 Ų, (Prop-2-ynyloxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Prop-2-ynyloxy)benzene 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 (Prop-2-ynyloxy)benzene?
The CAS number of (Prop-2-ynyloxy)benzene is 13610-02-1.
What is the molecular formula of (Prop-2-ynyloxy)benzene?
The molecular formula of (Prop-2-ynyloxy)benzene is C9H8O.
What is the molecular weight of (Prop-2-ynyloxy)benzene?
The molecular weight of (Prop-2-ynyloxy)benzene is 132.06 g/mol.
Where can I buy (Prop-2-ynyloxy)benzene?
You can request a quote for (Prop-2-ynyloxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Prop-2-ynyloxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for (Prop-2-ynyloxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.