Hexadiene
TL;DR: Hexadiene (CAS 592-48-3) 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.
hexa-1,3-diene
Also Known As: hexa-1,3-diene, 1,3-HEXADIENE, HEXADIENE, n-Hexadien, 1,a3-aHexadiene
| Molecular Formula | C6H10 |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 3.2 |
| 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 | 51.0 |
Chemical Identifiers
| CAS Number | 592-48-3 |
|---|---|
| SMILES | CCC=CC=C |
| InChIKey | AHAREKHAZNPPMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexadiene (CAS 592-48-3), with molecular formula C6H10 and molecular weight 82.08 g/mol. IUPAC: hexa-1,3-diene.
Chemical Property Profile of Hexadiene
Property Insights of Hexadiene
The XLogP value of 3.2 indicates that Hexadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Hexadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadiene 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 Hexadiene?
The CAS number of Hexadiene is 592-48-3.
What is the molecular formula of Hexadiene?
The molecular formula of Hexadiene is C6H10.
What is the molecular weight of Hexadiene?
The molecular weight of Hexadiene is 82.08 g/mol.
Where can I buy Hexadiene?
You can request a quote for Hexadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadiene?
Yes, KEHONG BIO provides custom synthesis services for Hexadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.