RefChem:476777
TL;DR: RefChem:476777 (CAS 5858-88-8) is a chemical compound with molecular formula C32H20BaCl2N4O8S2 and molecular weight 859.9152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
barium(2+);bis(5-[(2-chlorophenyl)diazenyl]-6-hydroxynaphthalene-2-sulfonate)
Also Known As: C16H11ClN2O4S.1/2Ba, C16-H11-Cl-N2-O4-S.1/2Ba, 2-Naphthalenesulfonic acid, 5-[(2-chlorophenyl)azo]-6-hydroxy-, barium salt (2:1), C.I. Pigment Orange 19, barium salt (2:1), barium5-[ azo]-6-hydroxynaphthalene-2-sulphonate
Technical Specifications
| Molecular Formula | C32H20BaCl2N4O8S2 |
| Molecular Weight | 859.9152 g/mol |
| XLogP | 8.66 |
| Topological Polar Surface Area (TPSA) | 221.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 859.9152 Da |
| Heavy Atoms | 49 |
| Complexity | 552.0 |
| SMILES | C1=CC=C(C(=C1)N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])O)Cl.C1=CC=C(C(=C1)N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])O)Cl.[Ba+2] |
| InChIKey | LFHHQQPDUWHUAA-UHFFFAOYSA-L |
Chemical Property Profile of RefChem:476777
Property Insights of RefChem:476777
The XLogP value of 8.66 indicates that RefChem:476777 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 221.0 Ų indicates high polarity, suggesting RefChem:476777 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:476777 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:476777?
The CAS number of RefChem:476777 is 5858-88-8.
What is the molecular formula of RefChem:476777?
The molecular formula of RefChem:476777 is C32H20BaCl2N4O8S2.
What is the molecular weight of RefChem:476777?
The molecular weight of RefChem:476777 is 859.9152 g/mol.
Where can I buy RefChem:476777?
You can request a quote for RefChem:476777 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:476777?
Yes, CoreyChem provides custom synthesis services for RefChem:476777 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.