1-己炔
TL;DR: 1-己炔 (CAS 693-02-7) is a chemical compound with molecular formula C6H10 and molecular weight 82.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-己炔
hex-1-yne
Also Known As: Hex-1-yne, Butylacetylene, n-Butylacetylene, HEXYNE, n-hexyne
| Molecular Formula | C6H10 |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 82.07825 |
| Heavy Atoms | 6 |
| Complexity | 53.0 |
| Vapor Pressure | 133.0 [mmHg] |
Chemical Identifiers
| CAS Number | 693-02-7 |
|---|---|
| SMILES | CCCCC#C |
| InChIKey | CGHIBGNXEGJPQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-己炔 (CAS 693-02-7), with molecular formula C6H10 and molecular weight 82.08 g/mol. IUPAC: hex-1-yne.
Chemical Property Profile of 1-己炔
Property Insights of 1-己炔
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-己炔. With a topological polar surface area (TPSA) of 0.0 Ų, 1-己炔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-己炔 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-己炔?
The CAS number of 1-己炔 is 693-02-7.
What is the molecular formula of 1-己炔?
The molecular formula of 1-己炔 is C6H10.
What is the molecular weight of 1-己炔?
The molecular weight of 1-己炔 is 82.08 g/mol.
Where can I buy 1-己炔?
You can request a quote for 1-己炔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-己炔?
Yes, KEHONG BIO provides custom synthesis services for 1-己炔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.