![3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione structure](/static/products/300/300587-43-3.png)
3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione
TL;DR: 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione (CAS 300587-43-3) is a chemical compound with molecular formula C31H36O3 and molecular weight 456.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-octoxyphenyl)-1,5-diphenylpentane-1,5-dione
Also Known As: BAS 00127543, AB01330366-02, 3-[4-(octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione, 3-(4-octoxyphenyl)-1,5-diphenylpentane-1,5-dione, 3-(4-(octyloxy)phenyl)-1,5-diphenylpentane-1,5-dione
| Molecular Formula | C31H36O3 |
|---|---|
| Molecular Weight | 456.27 g/mol |
| LogP | 8.0555 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 456.26645 |
| Heavy Atoms | 34 |
| Complexity | 940.36664 |
Chemical Identifiers
| CAS Number | 300587-43-3 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)CC(=O)C3=CC=CC=C3 |
Product Overview
3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione (CAS 300587-43-3), with molecular formula C31H36O3 and molecular weight 456.27 g/mol. IUPAC: 3-(4-octoxyphenyl)-1,5-diphenylpentane-1,5-dione.
Chemical Property Profile of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione
Property Insights of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione
The XLogP value of 8.0555 indicates that 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione?
The CAS number of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione is 300587-43-3.
What is the molecular formula of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione?
The molecular formula of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione is C31H36O3.
What is the molecular weight of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione?
The molecular weight of 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione is 456.27 g/mol.
Where can I buy 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione?
You can request a quote for 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(Octyloxy)phenyl]-1,5-diphenylpentane-1,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.