1,3,6-环辛三烯
TL;DR: 1,3,6-环辛三烯 (CAS 3725-30-2) is a chemical compound with molecular formula C8H10 and molecular weight 106.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,6-环辛三烯
cycloocta-1,3,6-triene
Also Known As: cycloocta-1,3,6-triene, (1Z,3Z,6Z)-cycloocta-1,3,6-triene
| Molecular Formula | C8H10 |
|---|---|
| Molecular Weight | 106.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 106.07825 |
| Heavy Atoms | 8 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 3725-30-2 |
|---|---|
| SMILES | C1C=CCC=CC=C1 |
| InChIKey | LHNSMWDERKGLJK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,6-环辛三烯 (CAS 3725-30-2), with molecular formula C8H10 and molecular weight 106.08 g/mol. IUPAC: cycloocta-1,3,6-triene.
Chemical Property Profile of 1,3,6-环辛三烯
Property Insights of 1,3,6-环辛三烯
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,6-环辛三烯. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3,6-环辛三烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,6-环辛三烯 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 1,3,6-环辛三烯?
The CAS number of 1,3,6-环辛三烯 is 3725-30-2.
What is the molecular formula of 1,3,6-环辛三烯?
The molecular formula of 1,3,6-环辛三烯 is C8H10.
What is the molecular weight of 1,3,6-环辛三烯?
The molecular weight of 1,3,6-环辛三烯 is 106.08 g/mol.
Where can I buy 1,3,6-环辛三烯?
You can request a quote for 1,3,6-环辛三烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,6-环辛三烯?
Yes, KEHONG BIO provides custom synthesis services for 1,3,6-环辛三烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.