2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine
TL;DR: 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine (CAS 119457-81-7) is a chemical compound with molecular formula C96H146N8O8 and molecular weight 1539.1263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7,15,16,24,25,33,34-octaoctoxy-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),4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(37),31,33,35-nonadecaene
Also Known As: 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine, 6,7,15,16,24,25,33,34-Octaoctoxy-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),4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(37),31,33,35-nonadecaene
Technical Specifications
| Molecular Formula | C96H146N8O8 |
| Molecular Weight | 1539.1263 g/mol |
| XLogP | 33.5 |
| Topological Polar Surface Area (TPSA) | 183.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 64 |
| Exact Mass | 1539.1263 Da |
| Heavy Atoms | 112 |
| Complexity | 2290.0 |
| SMILES | CCCCCCCCOC1=CC2=C3NC(=C2C=C1OCCCCCCCC)N=C4C5=CC(=C(C=C5C(=N4)N=C6C7=CC(=C(C=C7C(=N6)N=C8C9=CC(=C(C=C9C(=N8)N3)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC |
| InChIKey | URYRXSHEJQXAAO-UHFFFAOYSA-N |
Chemical Property Profile of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine
Property Insights of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine
The XLogP value of 33.5 indicates that 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 183.0 Ų indicates high polarity, suggesting 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine?
The CAS number of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine is 119457-81-7.
What is the molecular formula of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine?
The molecular formula of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine is C96H146N8O8.
What is the molecular weight of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine?
The molecular weight of 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine is 1539.1263 g/mol.
Where can I buy 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine?
You can request a quote for 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine?
Yes, CoreyChem provides custom synthesis services for 2,3,9,10,16,17,23,24-Octakis(octyloxy)-29H,31H-phthalocyanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.