Hex-5-ynal
TL;DR: Hex-5-ynal (CAS 29329-03-1) is a chemical compound with molecular formula C6H8O and molecular weight 96.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hex-5-ynal
Also Known As: 5-hexynal, Hex-5-ynal, 5-Hexyne-1-al, hex-5-yn-1-al, JIBLCOIURXDOGU-UHFFFAOYSA-
| Molecular Formula | C6H8O |
|---|---|
| Molecular Weight | 96.06 g/mol |
| LogP | 0.9888 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 96.05752 |
| Heavy Atoms | 7 |
| Complexity | 78.671036 |
Chemical Identifiers
| CAS Number | 29329-03-1 |
|---|---|
| SMILES | C#CCCCC=O |
Product Overview
Hex-5-ynal (CAS 29329-03-1), with molecular formula C6H8O and molecular weight 96.06 g/mol. IUPAC: hex-5-ynal.
Chemical Property Profile of Hex-5-ynal
Property Insights of Hex-5-ynal
The XLogP value of 0.9888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hex-5-ynal. With a topological polar surface area (TPSA) of 17.07 Ų, Hex-5-ynal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hex-5-ynal 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 Hex-5-ynal?
The CAS number of Hex-5-ynal is 29329-03-1.
What is the molecular formula of Hex-5-ynal?
The molecular formula of Hex-5-ynal is C6H8O.
What is the molecular weight of Hex-5-ynal?
The molecular weight of Hex-5-ynal is 96.06 g/mol.
Where can I buy Hex-5-ynal?
You can request a quote for Hex-5-ynal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hex-5-ynal?
Yes, KEHONG BIO provides custom synthesis services for Hex-5-ynal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.