Hexadecachlorophthalocyanine
TL;DR: Hexadecachlorophthalocyanine (CAS 28888-81-5) is a chemical compound with molecular formula C32H2Cl16N8 and molecular weight 1057.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7,8,14,15,16,17,23,24,25,26,32,33,34,35-hexadecachloro-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),5,7,10,12(39),13(18),14,16,19,21,23,25,27,30(37),31(36),32,34-nonadecaene
Also Known As: Hexadecachlorophthalocyanine
| Molecular Formula | C32H2Cl16N8 |
|---|---|
| Molecular Weight | 1057.54 g/mol |
| LogP | 16.4 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 1065.53 |
| Heavy Atoms | 56 |
| Complexity | 1470.0 |
Chemical Identifiers
| CAS Number | 28888-81-5 |
|---|---|
| SMILES | C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C3=NC4=NC(=NC5=NC(=NC6=C7C(=C(N6)NC2=N3)C(=C(C(=C7Cl)Cl)Cl)Cl)C8=C5C(=C(C(=C8Cl)Cl)Cl)Cl)C9=C4C(=C(C(=C9Cl)Cl)Cl)Cl |
| InChIKey | PQAXGPJSVFSKAI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexadecachlorophthalocyanine (CAS 28888-81-5), with molecular formula C32H2Cl16N8 and molecular weight 1057.54 g/mol. IUPAC: 5,6,7,8,14,15,16,17,23,24,25,26,32,33,34,35-hexadecachloro-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),5,7,10,12(39),13(18),14,16,19,21,23,25,27,30(37),31(36),32,34-nonadecaene.
Chemical Property Profile of Hexadecachlorophthalocyanine
Property Insights of Hexadecachlorophthalocyanine
The XLogP value of 16.4 indicates that Hexadecachlorophthalocyanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexadecachlorophthalocyanine. Following Lipinski's Rule of Five, Hexadecachlorophthalocyanine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexadecachlorophthalocyanine?
The CAS number of Hexadecachlorophthalocyanine is 28888-81-5.
What is the molecular formula of Hexadecachlorophthalocyanine?
The molecular formula of Hexadecachlorophthalocyanine is C32H2Cl16N8.
What is the molecular weight of Hexadecachlorophthalocyanine?
The molecular weight of Hexadecachlorophthalocyanine is 1057.54 g/mol.
Where can I buy Hexadecachlorophthalocyanine?
You can request a quote for Hexadecachlorophthalocyanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecachlorophthalocyanine?
Yes, KEHONG BIO provides custom synthesis services for Hexadecachlorophthalocyanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.