tin(IV) chlorin e6
TL;DR: tin(IV) chlorin e6 (CAS 13061-27-3) is a chemical compound with molecular formula C34H32N4O6Sn and molecular weight 712.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[20-(carboxylatomethyl)-18-(dioxidomethylidene)-8-ethenyl-13-ethyl-3,7,12,17-tetramethyl-2,3-dihydroporphyrin-23-id-2-yl]propanoate;hydron;tin(4+)
Also Known As: Tin(IV) chlorin e6, SnCe6, (SP-4-2-(2S-trans))-(18-Carboxy-20-(carboxymethyl)-8-ethenyl-13-ethyl-2,3-dihydro-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanoato(5-)-N21,N22,N23,N24)stannate(1-) hydrogen, 3-[20-(carboxylatomethyl)-18-(dioxidomethylidene)-8-ethenyl-13-ethyl-3,7,12,17-tetramethyl-2,3-dihydroporphyrin-23-id-2-yl]propanoate;hydron;tin(4+), tin(4+) hydrogen 3-[20-(carboxylatomethyl)-18-(dioxidomethylidene)-8-ethenyl-13-ethyl-3,7,12,17-tetramethyl-3,18-dihydro-2h-porphin-23-id-2-yl]propanoate(1:1:1)
| Molecular Formula | C34H32N4O6Sn |
|---|---|
| Molecular Weight | 712.13 g/mol |
| LogP | -1.04618 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 712.1344 |
| Heavy Atoms | 45 |
| Complexity | 1750.0 |
Chemical Identifiers
| CAS Number | 13061-27-3 |
|---|---|
| SMILES | [H+].CCC1=C(C2=CC3=NC(=CC4=NC(=C(C5=NC(=C(C5=C([O-])[O-])C)C=C1[N-]2)CC(=O)[O-])C(C4C)CCC(=O)[O-])C(=C3C=C)C)C.[Sn+4] |
| InChIKey | FNPOHMCPKIQLBU-UHFFFAOYSA-J |
Product Overview
tin(IV) chlorin e6 (CAS 13061-27-3), with molecular formula C34H32N4O6Sn and molecular weight 712.13 g/mol. IUPAC: 3-[20-(carboxylatomethyl)-18-(dioxidomethylidene)-8-ethenyl-13-ethyl-3,7,12,17-tetramethyl-2,3-dihydroporphyrin-23-id-2-yl]propanoate;hydron;tin(4+).
Chemical Property Profile of tin(IV) chlorin e6
Property Insights of tin(IV) chlorin e6
The XLogP value of -1.04618 indicates that tin(IV) chlorin e6 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 164.0 Ų indicates high polarity, suggesting tin(IV) chlorin e6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, tin(IV) chlorin e6 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tin(IV) chlorin e6?
The CAS number of tin(IV) chlorin e6 is 13061-27-3.
What is the molecular formula of tin(IV) chlorin e6?
The molecular formula of tin(IV) chlorin e6 is C34H32N4O6Sn.
What is the molecular weight of tin(IV) chlorin e6?
The molecular weight of tin(IV) chlorin e6 is 712.13 g/mol.
Where can I buy tin(IV) chlorin e6?
You can request a quote for tin(IV) chlorin e6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tin(IV) chlorin e6?
Yes, KEHONG BIO provides custom synthesis services for tin(IV) chlorin e6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.