trans-3-Hexene
TL;DR: trans-3-Hexene (CAS 68526-52-3) is a chemical compound with molecular formula C6H12 and molecular weight 84.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-hex-3-ene
Also Known As: trans-3-Hexene, 3-HEXENE, (E)-hex-3-ene, 3-hexene, (3E)-, (E)-3-Hexene
| Molecular Formula | C6H12 |
|---|---|
| Molecular Weight | 84.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 84.0939 |
| Heavy Atoms | 6 |
| Complexity | 29.0 |
Chemical Identifiers
| CAS Number | 68526-52-3 |
|---|---|
| SMILES | CC/C=C/CC |
| InChIKey | ZQDPJFUHLCOCRG-AATRIKPKSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
trans-3-Hexene (CAS 68526-52-3), with molecular formula C6H12 and molecular weight 84.09 g/mol. IUPAC: (E)-hex-3-ene.
Chemical Property Profile of trans-3-Hexene
Property Insights of trans-3-Hexene
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-3-Hexene. With a topological polar surface area (TPSA) of 0.0 Ų, trans-3-Hexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-3-Hexene 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 trans-3-Hexene?
The CAS number of trans-3-Hexene is 68526-52-3.
What is the molecular formula of trans-3-Hexene?
The molecular formula of trans-3-Hexene is C6H12.
What is the molecular weight of trans-3-Hexene?
The molecular weight of trans-3-Hexene is 84.09 g/mol.
Where can I buy trans-3-Hexene?
You can request a quote for trans-3-Hexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-3-Hexene?
Yes, KEHONG BIO provides custom synthesis services for trans-3-Hexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.