Ferric chlorin
TL;DR: Ferric chlorin (CAS 119387-63-2) is a chemical compound with molecular formula C33H35FeN4O4 and molecular weight 607.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[18-(2-carboxylatoethyl)-3,7,8,12,12,13,17-heptamethyl-13H-porphyrin-21,22-diid-2-yl]propanoate;hydron;iron(3+)
Also Known As: Ferric chlorin, Iron(III) chlorin, Ferrate(1-), (7,8-dihydro-3,7,8,8,12,13,17-heptamethyl-21H,23H-porphine-2,18-dipropanoato(4-)-N21,N22,N23,N24)-, hydrogen, (SP-4-2-)-, 3-[18-(2-carboxylatoethyl)-3,7,8,12,12,13,17-heptamethyl-13H-porphyrin-21,22-diid-2-yl]propanoate;hydron;iron(3+), 3-[3,7,8,12,12,13,17-heptamethyl-18-(3-oxido-3-oxopropyl)-13H-porphyrin-21,22-diid-2-yl]propanoate; hydron; iron(3+)
| Molecular Formula | C33H35FeN4O4 |
|---|---|
| Molecular Weight | 607.20 g/mol |
| LogP | 3.83286 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 607.20074 |
| Heavy Atoms | 42 |
| Complexity | 948.0 |
Chemical Identifiers
| CAS Number | 119387-63-2 |
|---|---|
| SMILES | [H+].CC1C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=CC(=N2)C1(C)C)[N-]5)C)C)C)CCC(=O)[O-])C(=C3C)CCC(=O)[O-].[Fe+3] |
| InChIKey | SLYZIQLDWVTYHU-UHFFFAOYSA-K |
Product Overview
Ferric chlorin (CAS 119387-63-2), with molecular formula C33H35FeN4O4 and molecular weight 607.20 g/mol. IUPAC: 3-[18-(2-carboxylatoethyl)-3,7,8,12,12,13,17-heptamethyl-13H-porphyrin-21,22-diid-2-yl]propanoate;hydron;iron(3+).
Chemical Property Profile of Ferric chlorin
Property Insights of Ferric chlorin
The XLogP value of 3.83286 indicates that Ferric chlorin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ferric chlorin. Following Lipinski's Rule of Five, Ferric chlorin has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ferric chlorin?
The CAS number of Ferric chlorin is 119387-63-2.
What is the molecular formula of Ferric chlorin?
The molecular formula of Ferric chlorin is C33H35FeN4O4.
What is the molecular weight of Ferric chlorin?
The molecular weight of Ferric chlorin is 607.20 g/mol.
Where can I buy Ferric chlorin?
You can request a quote for Ferric chlorin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ferric chlorin?
Yes, KEHONG BIO provides custom synthesis services for Ferric chlorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.