Octahelicene
TL;DR: Octahelicene (CAS 20495-12-9) is a chemical compound with molecular formula C34H20 and molecular weight 428.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octacyclo[16.16.0.02,15.03,12.04,9.021,34.024,33.027,32]tetratriaconta-1(18),2(15),3(12),4,6,8,10,13,16,19,21(34),22,24(33),25,27,29,31-heptadecaene
Also Known As: octahelicene, [8]Helicene, Naphtho[2,1-c, GJOJDDYVYWHRJW-UHFFFAOYSA, GJOJDDYVYWHRJW-UHFFFAOYSA-
| Molecular Formula | C34H20 |
|---|---|
| Molecular Weight | 428.16 g/mol |
| LogP | 10.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 428.1565 |
| Heavy Atoms | 34 |
| Complexity | 678.0 |
Chemical Identifiers
| CAS Number | 20495-12-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=C6C8=CC=CC=C8C=C7)C=C3 |
| InChIKey | GJOJDDYVYWHRJW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octahelicene (CAS 20495-12-9), with molecular formula C34H20 and molecular weight 428.16 g/mol. IUPAC: octacyclo[16.16.0.02,15.03,12.04,9.021,34.024,33.027,32]tetratriaconta-1(18),2(15),3(12),4,6,8,10,13,16,19,21(34),22,24(33),25,27,29,31-heptadecaene.
Chemical Property Profile of Octahelicene
Property Insights of Octahelicene
The XLogP value of 10.4 indicates that Octahelicene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Octahelicene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octahelicene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octahelicene?
The CAS number of Octahelicene is 20495-12-9.
What is the molecular formula of Octahelicene?
The molecular formula of Octahelicene is C34H20.
What is the molecular weight of Octahelicene?
The molecular weight of Octahelicene is 428.16 g/mol.
Where can I buy Octahelicene?
You can request a quote for Octahelicene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octahelicene?
Yes, KEHONG BIO provides custom synthesis services for Octahelicene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.