RefChem:578921
TL;DR: RefChem:578921 (CAS 23970-06-1) is a chemical compound with molecular formula C32H8Cl8CuN8 and molecular weight 846.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper 6,8,15,17,24,26,33,35-octachloro-2,11,20,37,39,40-hexaza-29,38-diazanidanonacyclo[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: Copper, (1,3,8,10,15,17,22,24-octachloro-29H,31H-phthalocyaninato(2-)-kappaN29,kappaN30,kappaN31,kappaN32)-, (SP-4-1)-, [1,3,8,10,15,17,22,24-octachloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]copper, Copper(2+) 2,4,9,11,16,18,23,25-octachlorophthalocyanine-6,29-diide, Copper, (1,3,8,10,15,17,22,24-octachloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32)-, (1,3,8,10,15,17,22,24-Octachloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32)copper
| Molecular Formula | C32H8Cl8CuN8 |
|---|---|
| Molecular Weight | 846.77 g/mol |
| LogP | 11.2553 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 846.76764 |
| Heavy Atoms | 49 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 23970-06-1 |
|---|---|
| SMILES | C1=C(C=C(C2=C1C3=NC2=NC4=NC(=NC5=NC(=NC6=C7C=C(C=C(C7=C([N-]6)[N-]3)Cl)Cl)C8=C5C=C(C=C8Cl)Cl)C9=C4C=C(C=C9Cl)Cl)Cl)Cl.[Cu+2] |
| InChIKey | BEYOWWQAPXEJAM-UHFFFAOYSA-N |
Product Overview
RefChem:578921 (CAS 23970-06-1), with molecular formula C32H8Cl8CuN8 and molecular weight 846.77 g/mol. IUPAC: copper 6,8,15,17,24,26,33,35-octachloro-2,11,20,37,39,40-hexaza-29,38-diazanidanonacyclo[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 RefChem:578921
Property Insights of RefChem:578921
The XLogP value of 11.2553 indicates that RefChem:578921 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:578921. Following Lipinski's Rule of Five, RefChem:578921 has 0 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 RefChem:578921?
The CAS number of RefChem:578921 is 23970-06-1.
What is the molecular formula of RefChem:578921?
The molecular formula of RefChem:578921 is C32H8Cl8CuN8.
What is the molecular weight of RefChem:578921?
The molecular weight of RefChem:578921 is 846.77 g/mol.
Where can I buy RefChem:578921?
You can request a quote for RefChem:578921 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:578921?
Yes, KEHONG BIO provides custom synthesis services for RefChem:578921 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.