2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone
TL;DR: 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone (CAS 52186-18-2) is a chemical compound with molecular formula C21H20O and molecular weight 288.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(2E,3R,4R,5E)-2,5-dibenzylidene-3,4-dimethylcyclopentan-1-one
Also Known As: 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone, trans-3,4-Dimethyl-2,5-bis(phenylmethylene)cyclopentanone, Cyclopentanone, 3,4-dimethyl-2,5-bis(phenylmethylene)-, trans-, (2E,3R,4R,5E)-2,5-dibenzylidene-3,4-dimethylcyclopentan-1-one
| Molecular Formula | C21H20O |
|---|---|
| Molecular Weight | 288.15 g/mol |
| LogP | 5.0085 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.15143 |
| Heavy Atoms | 22 |
| Complexity | 659.51715 |
Chemical Identifiers
| CAS Number | 52186-18-2 |
|---|---|
| SMILES | C[C@H]1/C(=C\C2=CC=CC=C2)/C(=O)/C(=C/C3=CC=CC=C3)/[C@@H]1C |
Product Overview
2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone (CAS 52186-18-2), with molecular formula C21H20O and molecular weight 288.15 g/mol. IUPAC: trans-(2E,3R,4R,5E)-2,5-dibenzylidene-3,4-dimethylcyclopentan-1-one.
Chemical Property Profile of 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone
Property Insights of 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone
The XLogP value of 5.0085 indicates that 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone 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 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone?
The CAS number of 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone is 52186-18-2.
What is the molecular formula of 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone?
The molecular formula of 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone is C21H20O.
What is the molecular weight of 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone?
The molecular weight of 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone is 288.15 g/mol.
Where can I buy 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone?
You can request a quote for 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dibenzylidene-trans-3,4-dimethylcyclopentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.