18-Pentatriacontanone
TL;DR: 18-Pentatriacontanone (CAS 504-53-0) is a chemical compound with molecular formula C35H70O and molecular weight 506.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentatriacontan-18-one
Also Known As: 18-PENTATRIACONTANONE, Stearone, pentatriacontan-18-one, Diheptadecyl ketone, Heptadecyl ketone
| Molecular Formula | C35H70O |
|---|---|
| Molecular Weight | 506.54 g/mol |
| LogP | 16.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 32 |
| Exact Mass | 506.54266 |
| Heavy Atoms | 36 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 504-53-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCCC |
| InChIKey | DMCJFWXGXUEHFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
18-Pentatriacontanone (CAS 504-53-0), with molecular formula C35H70O and molecular weight 506.54 g/mol. IUPAC: pentatriacontan-18-one.
Chemical Property Profile of 18-Pentatriacontanone
Property Insights of 18-Pentatriacontanone
The XLogP value of 16.8 indicates that 18-Pentatriacontanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 18-Pentatriacontanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 18-Pentatriacontanone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 18-Pentatriacontanone?
The CAS number of 18-Pentatriacontanone is 504-53-0.
What is the molecular formula of 18-Pentatriacontanone?
The molecular formula of 18-Pentatriacontanone is C35H70O.
What is the molecular weight of 18-Pentatriacontanone?
The molecular weight of 18-Pentatriacontanone is 506.54 g/mol.
Where can I buy 18-Pentatriacontanone?
You can request a quote for 18-Pentatriacontanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 18-Pentatriacontanone?
Yes, KEHONG BIO provides custom synthesis services for 18-Pentatriacontanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.