1-戊炔
TL;DR: 1-戊炔 (CAS 627-19-0) is a chemical compound with molecular formula C5H8 and molecular weight 68.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-戊炔
pent-1-yne
Also Known As: 1-PENTYNE, pent-1-yne, Propylacetylene, Pentyne, pentin
| Molecular Formula | C5H8 |
|---|---|
| Molecular Weight | 68.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 68.0626 |
| Heavy Atoms | 5 |
| Complexity | 44.0 |
| Vapor Pressure | 436.0 [mmHg] |
Chemical Identifiers
| CAS Number | 627-19-0 |
|---|---|
| SMILES | CCCC#C |
| InChIKey | IBXNCJKFFQIKKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-戊炔 (CAS 627-19-0), with molecular formula C5H8 and molecular weight 68.06 g/mol. IUPAC: pent-1-yne.
Chemical Property Profile of 1-戊炔
Property Insights of 1-戊炔
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-戊炔. With a topological polar surface area (TPSA) of 0.0 Ų, 1-戊炔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-戊炔 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-戊炔?
The CAS number of 1-戊炔 is 627-19-0.
What is the molecular formula of 1-戊炔?
The molecular formula of 1-戊炔 is C5H8.
What is the molecular weight of 1-戊炔?
The molecular weight of 1-戊炔 is 68.06 g/mol.
Where can I buy 1-戊炔?
You can request a quote for 1-戊炔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-戊炔?
Yes, KEHONG BIO provides custom synthesis services for 1-戊炔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.