2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone
TL;DR: 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone (CAS 445287-69-4) is a chemical compound with molecular formula C29H36O5 and molecular weight 464.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,5E)-2,5-bis[(3-ethoxy-4-propan-2-yloxyphenyl)methylidene]cyclopentan-1-one
Also Known As: 2,5-bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone, (2E,5E)-2,5-bis[(3-ethoxy-4-propan-2-yloxyphenyl)methylidene]cyclopentan-1-one, (2E,5E)-2,5-bis[3-ethoxy-4-(propan-2-yloxy)benzylidene]cyclopentanone, 2,5-BIS[(E)-1-(3-ETHOXY-4-ISOPROPOXYPHENYL)METHYLIDENE]-1-CYCLOPENTANONE
| Molecular Formula | C29H36O5 |
|---|---|
| Molecular Weight | 464.26 g/mol |
| LogP | 6.8883 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 464.2563 |
| Heavy Atoms | 34 |
| Complexity | 978.6858 |
Chemical Identifiers
| CAS Number | 445287-69-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/C(=O)/C(=C/C3=CC(=C(C=C3)OC(C)C)OCC)/CC2)OC(C)C |
Product Overview
2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone (CAS 445287-69-4), with molecular formula C29H36O5 and molecular weight 464.26 g/mol. IUPAC: (2E,5E)-2,5-bis[(3-ethoxy-4-propan-2-yloxyphenyl)methylidene]cyclopentan-1-one.
Chemical Property Profile of 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone
Property Insights of 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone
The XLogP value of 6.8883 indicates that 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.99 Ų, 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone has 0 hydrogen bond donor(s) and 5 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-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone?
The CAS number of 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone is 445287-69-4.
What is the molecular formula of 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone?
The molecular formula of 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone is C29H36O5.
What is the molecular weight of 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone?
The molecular weight of 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone is 464.26 g/mol.
Where can I buy 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone?
You can request a quote for 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(3-ethoxy-4-isopropoxybenzylidene)cyclopentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.