Hexacontane
TL;DR: Hexacontane (CAS 7667-80-3) is a chemical compound with molecular formula C60H122 and molecular weight 842.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexacontane
Also Known As: Hexacontane, N-HEXACONTANE, Hexacontane, 98%, Hexacontane; n-Hexacontane, 231-643-7
| Molecular Formula | C60H122 |
|---|---|
| Molecular Weight | 842.95 g/mol |
| LogP | 32.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 57 |
| Exact Mass | 842.95465 |
| Heavy Atoms | 60 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 7667-80-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
| InChIKey | OCWUCHKZAHTZAB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexacontane (CAS 7667-80-3), with molecular formula C60H122 and molecular weight 842.95 g/mol. IUPAC: hexacontane.
Chemical Property Profile of Hexacontane
Property Insights of Hexacontane
The XLogP value of 32.1 indicates that Hexacontane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Hexacontane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexacontane 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 Hexacontane?
The CAS number of Hexacontane is 7667-80-3.
What is the molecular formula of Hexacontane?
The molecular formula of Hexacontane is C60H122.
What is the molecular weight of Hexacontane?
The molecular weight of Hexacontane is 842.95 g/mol.
Where can I buy Hexacontane?
You can request a quote for Hexacontane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexacontane?
Yes, KEHONG BIO provides custom synthesis services for Hexacontane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.