1,1'-Dibutylferrocene
TL;DR: 1,1'-Dibutylferrocene (CAS 1274-08-4) is a chemical compound with molecular formula C18H26Fe and molecular weight 298.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(1-butylcyclopenta-1,3-diene);iron(2+)
Also Known As: Dibutylferrocene, 1,1'-Dibutylferrocene, 1,1'-di-n-Butylferrocene, 1-butylcyclopenta-1,3-diene;iron(2+), 1,1/'-DI-N-BUTYLFERROCENE
| Molecular Formula | C18H26Fe |
|---|---|
| Molecular Weight | 298.14 g/mol |
| LogP | 5.49 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.1384 |
| Heavy Atoms | 19 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 1274-08-4 |
|---|---|
| SMILES | CCCCC1=CC=C[CH-]1.CCCCC1=CC=C[CH-]1.[Fe+2] |
| InChIKey | FJUFINOZWSTZEZ-UHFFFAOYSA-N |
Product Overview
1,1'-Dibutylferrocene (CAS 1274-08-4), with molecular formula C18H26Fe and molecular weight 298.14 g/mol. IUPAC: bis(1-butylcyclopenta-1,3-diene);iron(2+).
Chemical Property Profile of 1,1'-Dibutylferrocene
Property Insights of 1,1'-Dibutylferrocene
The XLogP value of 5.49 indicates that 1,1'-Dibutylferrocene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1'-Dibutylferrocene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Dibutylferrocene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-Dibutylferrocene?
The CAS number of 1,1'-Dibutylferrocene is 1274-08-4.
What is the molecular formula of 1,1'-Dibutylferrocene?
The molecular formula of 1,1'-Dibutylferrocene is C18H26Fe.
What is the molecular weight of 1,1'-Dibutylferrocene?
The molecular weight of 1,1'-Dibutylferrocene is 298.14 g/mol.
Where can I buy 1,1'-Dibutylferrocene?
You can request a quote for 1,1'-Dibutylferrocene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Dibutylferrocene?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Dibutylferrocene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.