RefChem:76519
TL;DR: RefChem:76519 (CAS 68227-72-5) is a chemical compound with molecular formula C32H21N5Na2O6S2 and molecular weight 681.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;8-anilino-5-[(4-phenyldiazenyl-6-sulfonatonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate
Also Known As: 1-Naphthalenesulfonic acid, 8-(phenylamino)-5-((4-(phenylazo)-6-sulfo-1-naphthalenyl)azo)-, disodium salt, 1-Naphthalenesulfonic acid, 8-(phenylamino)-5-(2-(4-(2-phenyldiazenyl)-6-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:2), 8-(phenylamino)-5-4-(phenylazo)-6-sulphonato-1-naphthylazonaphthalene-1-sulphonate (sodium salt), 1-Naphthalenesulfonic acid, 8-(phenylamino)-5-[[4-(phenylazo)-6-sulfo-1-naphthalenyl]azo]-, disodium salt, 1-Naphthalenesulfonic acid, 8-(phenylamino)-5-[2-[4-(2-phenyldiazenyl)-6-sulfo-1-naphthalenyl]diazenyl]-, sodium salt (1:2)
| Molecular Formula | C32H21N5Na2O6S2 |
|---|---|
| Molecular Weight | 681.07 g/mol |
| LogP | 2.38 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 681.0729 |
| Heavy Atoms | 47 |
| Complexity | 1230.0 |
Chemical Identifiers
| CAS Number | 68227-72-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N=NC6=CC=CC=C6)S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | NNEGULCNRRYWQY-UHFFFAOYSA-L |
Product Overview
RefChem:76519 (CAS 68227-72-5), with molecular formula C32H21N5Na2O6S2 and molecular weight 681.07 g/mol. IUPAC: disodium;8-anilino-5-[(4-phenyldiazenyl-6-sulfonatonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate.
Chemical Property Profile of RefChem:76519
Property Insights of RefChem:76519
The XLogP value of 2.38 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:76519. The TPSA of 193.0 Ų indicates high polarity, suggesting RefChem:76519 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:76519 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:76519?
The CAS number of RefChem:76519 is 68227-72-5.
What is the molecular formula of RefChem:76519?
The molecular formula of RefChem:76519 is C32H21N5Na2O6S2.
What is the molecular weight of RefChem:76519?
The molecular weight of RefChem:76519 is 681.07 g/mol.
Where can I buy RefChem:76519?
You can request a quote for RefChem:76519 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:76519?
Yes, KEHONG BIO provides custom synthesis services for RefChem:76519 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.