RefChem:72885
TL;DR: RefChem:72885 (CAS 70729-64-5) is a chemical compound with molecular formula C22H17N5Na3O13PS3 and molecular weight 754.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium;trisodium;7-hydroxy-8-[[4-[[3-[hydroxy(oxido)phosphoryl]phenyl]diazenyl]-2-sulfonatophenyl]diazenyl]naphthalene-1,3-disulfonate
Also Known As: 1,3-Naphthalenedisulfonic acid, 7-hydroxy-8-((4-((3-phosphonophenyl)azo)-2-sulfophenyl)azo)-, monoammonium trisodium salt, 1,3-Naphthalenedisulfonic acid, 7-hydroxy-8-(2-(4-(2-(3-phosphonophenyl)diazenyl)-2-sulfophenyl)diazenyl)-, ammonium sodium salt (1:1:3), 1-((4-((3-Phosphonophenyl)azo)-2-sulfophenyl)azo)-2-hydroxy-6,8-naphthalenedisulfonic acid, trisodium monoammonium salt, 1,3-Naphthalenedisulfonic acid, 7-hydroxy-8-[[4-[(3-phosphonophenyl)azo]-2-sulfophenyl]azo]-, monoammonium trisodium salt, 1,3-Naphthalenedisulfonic acid, 7-hydroxy-8-[2-[4-[2-(3-phosphonophenyl)diazenyl]-2-sulfophenyl]diazenyl]-, ammonium sodium salt (1:1:3)
| Molecular Formula | C22H17N5Na3O13PS3 |
|---|---|
| Molecular Weight | 754.94 g/mol |
| LogP | -6.3523 |
| Topological Polar Surface Area | 328.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 5 |
| Exact Mass | 754.9416 |
| Heavy Atoms | 47 |
| Complexity | 1390.0 |
Chemical Identifiers
| CAS Number | 70729-64-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)P(=O)(O)[O-])N=NC2=CC(=C(C=C2)N=NC3=C(C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)[O-].[NH4+].[Na+].[Na+].[Na+] |
| InChIKey | LMDCIBKKADONFG-UHFFFAOYSA-K |
Product Overview
RefChem:72885 (CAS 70729-64-5), with molecular formula C22H17N5Na3O13PS3 and molecular weight 754.94 g/mol. IUPAC: azanium;trisodium;7-hydroxy-8-[[4-[[3-[hydroxy(oxido)phosphoryl]phenyl]diazenyl]-2-sulfonatophenyl]diazenyl]naphthalene-1,3-disulfonate.
Chemical Property Profile of RefChem:72885
Property Insights of RefChem:72885
The XLogP value of -6.3523 indicates that RefChem:72885 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 328.0 Ų indicates high polarity, suggesting RefChem:72885 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:72885 has 3 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:72885?
The CAS number of RefChem:72885 is 70729-64-5.
What is the molecular formula of RefChem:72885?
The molecular formula of RefChem:72885 is C22H17N5Na3O13PS3.
What is the molecular weight of RefChem:72885?
The molecular weight of RefChem:72885 is 754.94 g/mol.
Where can I buy RefChem:72885?
You can request a quote for RefChem:72885 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:72885?
Yes, KEHONG BIO provides custom synthesis services for RefChem:72885 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.