1-Phenyl-1,3-octadecanedione
TL;DR: 1-Phenyl-1,3-octadecanedione (CAS 17281-74-2) is a chemical compound with molecular formula C24H38O2 and molecular weight 358.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyloctadecane-1,3-dione
Also Known As: 1-Phenyl-1,3-octadecanedione, 1-Phenyloctadecane-1,3-dione, palmitoylbenzoylmethane, Hexadecanoylbenzoylmethane, BENZOYLPALMITOYLMETHANE
| Molecular Formula | C24H38O2 |
|---|---|
| Molecular Weight | 358.29 g/mol |
| LogP | 8.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 358.28717 |
| Heavy Atoms | 26 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 17281-74-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)CC(=O)C1=CC=CC=C1 |
| InChIKey | BKUAQOCVPRDREL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-1,3-octadecanedione (CAS 17281-74-2), with molecular formula C24H38O2 and molecular weight 358.29 g/mol. IUPAC: 1-phenyloctadecane-1,3-dione.
Chemical Property Profile of 1-Phenyl-1,3-octadecanedione
Property Insights of 1-Phenyl-1,3-octadecanedione
The XLogP value of 8.8 indicates that 1-Phenyl-1,3-octadecanedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1-Phenyl-1,3-octadecanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-1,3-octadecanedione has 0 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 1-Phenyl-1,3-octadecanedione?
The CAS number of 1-Phenyl-1,3-octadecanedione is 17281-74-2.
What is the molecular formula of 1-Phenyl-1,3-octadecanedione?
The molecular formula of 1-Phenyl-1,3-octadecanedione is C24H38O2.
What is the molecular weight of 1-Phenyl-1,3-octadecanedione?
The molecular weight of 1-Phenyl-1,3-octadecanedione is 358.29 g/mol.
Where can I buy 1-Phenyl-1,3-octadecanedione?
You can request a quote for 1-Phenyl-1,3-octadecanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-1,3-octadecanedione?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-1,3-octadecanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.