Iron phthalate (2:3)
TL;DR: Iron phthalate (2:3) (CAS 52118-12-4) is a chemical compound with molecular formula C24H12Fe2O12 and molecular weight 603.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(iron(3+));phthalate
Also Known As: Iron phthalate (2:3), iron(3+); phthalate, Iron phthalate(2:3), EINECS 257-669-9, C8H6O4.2/3Fe
| Molecular Formula | C24H12Fe2O12 |
|---|---|
| Molecular Weight | 603.90 g/mol |
| LogP | -4.7642 |
| Topological Polar Surface Area | 240.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 603.9028 |
| Heavy Atoms | 38 |
| Complexity | 1061.5354 |
Chemical Identifiers
| CAS Number | 52118-12-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].[Fe+3].[Fe+3] |
Product Overview
Iron phthalate (2:3) (CAS 52118-12-4), with molecular formula C24H12Fe2O12 and molecular weight 603.90 g/mol. IUPAC: bis(iron(3+));phthalate.
Chemical Property Profile of Iron phthalate (2:3)
Property Insights of Iron phthalate (2:3)
The XLogP value of -4.7642 indicates that Iron phthalate (2:3) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 240.78 Ų indicates high polarity, suggesting Iron phthalate (2:3) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Iron phthalate (2:3) has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Iron phthalate (2:3)?
The CAS number of Iron phthalate (2:3) is 52118-12-4.
What is the molecular formula of Iron phthalate (2:3)?
The molecular formula of Iron phthalate (2:3) is C24H12Fe2O12.
What is the molecular weight of Iron phthalate (2:3)?
The molecular weight of Iron phthalate (2:3) is 603.90 g/mol.
Where can I buy Iron phthalate (2:3)?
You can request a quote for Iron phthalate (2:3) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iron phthalate (2:3)?
Yes, KEHONG BIO provides custom synthesis services for Iron phthalate (2:3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.