Di(benzoylcyclopentadienyl) Iron
TL;DR: Di(benzoylcyclopentadienyl) Iron (CAS 12180-80-2) is a chemical compound with molecular formula C24H18FeO2 and molecular weight 394.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(cyclopenta-1,3-dien-1-yl(phenyl)methanone);iron(2+)
Also Known As: 1,1'-Dibenzoylferrocene, Di(benzoylcyclopentadienyl) Iron, 1,1'-Dibenzoylferrocen, NCIOpen2_007146, Bis(benzoylcyclopentadienyl) Iron
| Molecular Formula | C24H18FeO2 |
|---|---|
| Molecular Weight | 394.07 g/mol |
| LogP | 5.27 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.0656 |
| Heavy Atoms | 27 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 12180-80-2 |
|---|---|
| SMILES | [CH-]1C=CC=C1C(=O)C2=CC=CC=C2.[CH-]1C=CC=C1C(=O)C2=CC=CC=C2.[Fe+2] |
| InChIKey | RFFFQOLCTAEBMA-UHFFFAOYSA-N |
Product Overview
Di(benzoylcyclopentadienyl) Iron (CAS 12180-80-2), with molecular formula C24H18FeO2 and molecular weight 394.07 g/mol. IUPAC: bis(cyclopenta-1,3-dien-1-yl(phenyl)methanone);iron(2+).
Chemical Property Profile of Di(benzoylcyclopentadienyl) Iron
Property Insights of Di(benzoylcyclopentadienyl) Iron
The XLogP value of 5.27 indicates that Di(benzoylcyclopentadienyl) Iron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, Di(benzoylcyclopentadienyl) Iron exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di(benzoylcyclopentadienyl) Iron has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Di(benzoylcyclopentadienyl) Iron?
The CAS number of Di(benzoylcyclopentadienyl) Iron is 12180-80-2.
What is the molecular formula of Di(benzoylcyclopentadienyl) Iron?
The molecular formula of Di(benzoylcyclopentadienyl) Iron is C24H18FeO2.
What is the molecular weight of Di(benzoylcyclopentadienyl) Iron?
The molecular weight of Di(benzoylcyclopentadienyl) Iron is 394.07 g/mol.
Where can I buy Di(benzoylcyclopentadienyl) Iron?
You can request a quote for Di(benzoylcyclopentadienyl) Iron directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di(benzoylcyclopentadienyl) Iron?
Yes, KEHONG BIO provides custom synthesis services for Di(benzoylcyclopentadienyl) Iron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.