8-Phenyloct-7-ene-2,4,6-trione
TL;DR: 8-Phenyloct-7-ene-2,4,6-trione (CAS 76538-35-7) is a chemical compound with molecular formula C14H14O3 and molecular weight 230.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-phenyloct-7-ene-2,4,6-trione
Also Known As: 8-phenyloct-7-ene-2,4,6-trione, (E)-8-phenyloct-7-ene-2,4,6-trione
| Molecular Formula | C14H14O3 |
|---|---|
| Molecular Weight | 230.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 230.0943 |
| Heavy Atoms | 17 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 76538-35-7 |
|---|---|
| SMILES | CC(=O)CC(=O)CC(=O)C=CC1=CC=CC=C1 |
| InChIKey | CRQYYTSELPIIBH-UHFFFAOYSA-N |
Product Overview
8-Phenyloct-7-ene-2,4,6-trione (CAS 76538-35-7), with molecular formula C14H14O3 and molecular weight 230.09 g/mol. IUPAC: 8-phenyloct-7-ene-2,4,6-trione.
Chemical Property Profile of 8-Phenyloct-7-ene-2,4,6-trione
Property Insights of 8-Phenyloct-7-ene-2,4,6-trione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Phenyloct-7-ene-2,4,6-trione. With a topological polar surface area (TPSA) of 51.2 Ų, 8-Phenyloct-7-ene-2,4,6-trione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Phenyloct-7-ene-2,4,6-trione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-Phenyloct-7-ene-2,4,6-trione?
The CAS number of 8-Phenyloct-7-ene-2,4,6-trione is 76538-35-7.
What is the molecular formula of 8-Phenyloct-7-ene-2,4,6-trione?
The molecular formula of 8-Phenyloct-7-ene-2,4,6-trione is C14H14O3.
What is the molecular weight of 8-Phenyloct-7-ene-2,4,6-trione?
The molecular weight of 8-Phenyloct-7-ene-2,4,6-trione is 230.09 g/mol.
Where can I buy 8-Phenyloct-7-ene-2,4,6-trione?
You can request a quote for 8-Phenyloct-7-ene-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Phenyloct-7-ene-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 8-Phenyloct-7-ene-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.