正己基-Δ3-THC
TL;DR: 正己基-Δ3-THC (CAS 117-51-1) is a chemical compound with molecular formula C22H32O2 and molecular weight 328.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
正己基-Δ3-THC
3-hexyl-6,6,9-trimethyl-7,8,9,10-tetrahydrobenzo[c]chromen-1-ol
Also Known As: Synhexyl, Parahexyl, Pyrahexyl, 3-Homotetrahydrocannibinol, SYNHEXYL [MI]
| Molecular Formula | C22H32O2 |
|---|---|
| Molecular Weight | 328.24 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.24023 |
| Heavy Atoms | 24 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 117-51-1 |
|---|---|
| SMILES | CCCCCCC1=CC(=C2C3=C(CCC(C3)C)C(OC2=C1)(C)C)O |
| InChIKey | OORFXDSWECAQLI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
正己基-Δ3-THC (CAS 117-51-1), with molecular formula C22H32O2 and molecular weight 328.24 g/mol. IUPAC: 3-hexyl-6,6,9-trimethyl-7,8,9,10-tetrahydrobenzo[c]chromen-1-ol.
Chemical Property Profile of 正己基-Δ3-THC
Property Insights of 正己基-Δ3-THC
The XLogP value of 6.2 indicates that 正己基-Δ3-THC is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 正己基-Δ3-THC exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 正己基-Δ3-THC has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 正己基-Δ3-THC?
The CAS number of 正己基-Δ3-THC is 117-51-1.
What is the molecular formula of 正己基-Δ3-THC?
The molecular formula of 正己基-Δ3-THC is C22H32O2.
What is the molecular weight of 正己基-Δ3-THC?
The molecular weight of 正己基-Δ3-THC is 328.24 g/mol.
Where can I buy 正己基-Δ3-THC?
You can request a quote for 正己基-Δ3-THC directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 正己基-Δ3-THC?
Yes, KEHONG BIO provides custom synthesis services for 正己基-Δ3-THC and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.