Pent-2-ynyloxirane
TL;DR: Pent-2-ynyloxirane (CAS 56956-21-9) is a chemical compound with molecular formula C7H10O and molecular weight 110.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pent-2-ynyloxirane
Also Known As: Pent-2-ynyloxirane, 2-Pentynyloxirane, 2-pent-2-ynyloxirane, 2-(pent-2-yn-1-yl)oxirane, Oxirane,2-(2-pentyn-1-yl)-
| Molecular Formula | C7H10O |
|---|---|
| Molecular Weight | 110.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 110.073166 |
| Heavy Atoms | 8 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 56956-21-9 |
|---|---|
| SMILES | CCC#CCC1CO1 |
| InChIKey | KJJIVFBKAQJUMY-UHFFFAOYSA-N |
Product Overview
Pent-2-ynyloxirane (CAS 56956-21-9), with molecular formula C7H10O and molecular weight 110.07 g/mol. IUPAC: 2-pent-2-ynyloxirane.
Chemical Property Profile of Pent-2-ynyloxirane
Property Insights of Pent-2-ynyloxirane
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pent-2-ynyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, Pent-2-ynyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pent-2-ynyloxirane 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 Pent-2-ynyloxirane?
The CAS number of Pent-2-ynyloxirane is 56956-21-9.
What is the molecular formula of Pent-2-ynyloxirane?
The molecular formula of Pent-2-ynyloxirane is C7H10O.
What is the molecular weight of Pent-2-ynyloxirane?
The molecular weight of Pent-2-ynyloxirane is 110.07 g/mol.
Where can I buy Pent-2-ynyloxirane?
You can request a quote for Pent-2-ynyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pent-2-ynyloxirane?
Yes, KEHONG BIO provides custom synthesis services for Pent-2-ynyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.