1,1'-Ferrocenedicarboxylic acid
TL;DR: 1,1'-Ferrocenedicarboxylic acid (CAS 1293-94-3) 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.
bis(cyclopenta-1,3-diene-1-carboxylic acid);iron(2+)
Also Known As: 1,1'-Ferrocenedicarboxylic acid, 1,1'-Dicarboxyferrocene, Ferrocene dicarboxylic acid, Bis(carboxycyclopentadienyl) Iron, Ferrocene, 1,1'-dicarboxy-
| Molecular Formula | C12H10FeO4 |
|---|---|
| Molecular Weight | 273.99 g/mol |
| LogP | 2.2049 |
| 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 | 229.0 |
Chemical Identifiers
| CAS Number | 1293-94-3 |
|---|---|
| SMILES | [CH-]1C=CC=C1C(=O)O.[CH-]1C=CC=C1C(=O)O.[Fe+2] |
| InChIKey | LDSUEKXPKCHROT-UHFFFAOYSA-N |
Product Overview
1,1'-Ferrocenedicarboxylic acid (CAS 1293-94-3), with molecular formula C12H10FeO4 and molecular weight 273.99 g/mol. IUPAC: bis(cyclopenta-1,3-diene-1-carboxylic acid);iron(2+).
Chemical Property Profile of 1,1'-Ferrocenedicarboxylic acid
Property Insights of 1,1'-Ferrocenedicarboxylic acid
The XLogP value of 2.2049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-Ferrocenedicarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-Ferrocenedicarboxylic acid. Following Lipinski's Rule of Five, 1,1'-Ferrocenedicarboxylic acid 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'-Ferrocenedicarboxylic acid?
The CAS number of 1,1'-Ferrocenedicarboxylic acid is 1293-94-3.
What is the molecular formula of 1,1'-Ferrocenedicarboxylic acid?
The molecular formula of 1,1'-Ferrocenedicarboxylic acid is C12H10FeO4.
What is the molecular weight of 1,1'-Ferrocenedicarboxylic acid?
The molecular weight of 1,1'-Ferrocenedicarboxylic acid is 273.99 g/mol.
Where can I buy 1,1'-Ferrocenedicarboxylic acid?
You can request a quote for 1,1'-Ferrocenedicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Ferrocenedicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Ferrocenedicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.