1,5-Diphenylpentan-3-one
TL;DR: 1,5-Diphenylpentan-3-one (CAS 5396-91-8) is a chemical compound with molecular formula C17H18O and molecular weight 238.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-diphenylpentan-3-one
Also Known As: 1,5-diphenylpentan-3-one, Diphenethyl ketone, Dibenzylacetone, 1,5-DIPHENYL-3-PENTANONE, Diphenethylketone
| Molecular Formula | C17H18O |
|---|---|
| Molecular Weight | 238.14 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 238.13577 |
| Heavy Atoms | 18 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 5396-91-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)CCC2=CC=CC=C2 |
| InChIKey | JENANTGGBLOTIB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5-Diphenylpentan-3-one (CAS 5396-91-8), with molecular formula C17H18O and molecular weight 238.14 g/mol. IUPAC: 1,5-diphenylpentan-3-one.
Chemical Property Profile of 1,5-Diphenylpentan-3-one
Property Insights of 1,5-Diphenylpentan-3-one
The XLogP value of 3.7 indicates that 1,5-Diphenylpentan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1,5-Diphenylpentan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Diphenylpentan-3-one has 0 hydrogen bond donor(s) and 1 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 1,5-Diphenylpentan-3-one?
The CAS number of 1,5-Diphenylpentan-3-one is 5396-91-8.
What is the molecular formula of 1,5-Diphenylpentan-3-one?
The molecular formula of 1,5-Diphenylpentan-3-one is C17H18O.
What is the molecular weight of 1,5-Diphenylpentan-3-one?
The molecular weight of 1,5-Diphenylpentan-3-one is 238.14 g/mol.
Where can I buy 1,5-Diphenylpentan-3-one?
You can request a quote for 1,5-Diphenylpentan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Diphenylpentan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Diphenylpentan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.