1,1'-二茂铁二甲酸
TL;DR: 1,1'-二茂铁二甲酸 (CAS 1293-87-4) is a chemical compound with molecular formula C12H10FeO4 and molecular weight 273.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1'-二茂铁二甲酸
bis(cyclopenta-2,4-diene-1-carboxylic acid);iron(2+)
Also Known As: 1,1'-Ferrocenedicarboxylic acid, cyclopenta-2,4-diene-1-carboxylic acid;iron(2+), I04-8603
| Molecular Formula | C12H10FeO4 |
|---|---|
| Molecular Weight | 273.99 g/mol |
| LogP | 1.23 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.99286 |
| Heavy Atoms | 17 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 1293-87-4 |
|---|---|
| SMILES | C1=CC([C-]=C1)C(=O)O.C1=CC([C-]=C1)C(=O)O.[Fe+2] |
| InChIKey | CESGGFICWDAAFA-UHFFFAOYSA-N |
Product Overview
1,1'-二茂铁二甲酸 (CAS 1293-87-4), with molecular formula C12H10FeO4 and molecular weight 273.99 g/mol. IUPAC: bis(cyclopenta-2,4-diene-1-carboxylic acid);iron(2+).
Chemical Property Profile of 1,1'-二茂铁二甲酸
Property Insights of 1,1'-二茂铁二甲酸
The XLogP value of 1.23 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-二茂铁二甲酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-二茂铁二甲酸. Following Lipinski's Rule of Five, 1,1'-二茂铁二甲酸 has 2 hydrogen bond donor(s) and 6 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 1,1'-二茂铁二甲酸?
The CAS number of 1,1'-二茂铁二甲酸 is 1293-87-4.
What is the molecular formula of 1,1'-二茂铁二甲酸?
The molecular formula of 1,1'-二茂铁二甲酸 is C12H10FeO4.
What is the molecular weight of 1,1'-二茂铁二甲酸?
The molecular weight of 1,1'-二茂铁二甲酸 is 273.99 g/mol.
Where can I buy 1,1'-二茂铁二甲酸?
You can request a quote for 1,1'-二茂铁二甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-二茂铁二甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-二茂铁二甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.