Diazanil Orange RR
TL;DR: Diazanil Orange RR (CAS 6104-56-9) is a chemical compound with molecular formula C41H28N7Na3O12S3 and molecular weight 975.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;7-[[4-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]benzoyl]amino]-2-methylphenyl]diazenyl]naphthalene-1,3-disulfonate
Also Known As: Diazanil Orange RR, Diazo Orange 2R, Phenazo Orange RR, C.I. Direct Orange 74, Pontamine Diazo Orange 2R
| Molecular Formula | C41H28N7Na3O12S3 |
|---|---|
| Molecular Weight | 975.07 g/mol |
| LogP | -1.35 |
| Topological Polar Surface Area | 351.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 8 |
| Exact Mass | 975.0651 |
| Heavy Atoms | 66 |
| Complexity | 1970.0 |
Chemical Identifiers
| CAS Number | 6104-56-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N=NC3=C(C=C4C=C(C=CC4=C3O)NC(=O)C5=CC=C(C=C5)N)S(=O)(=O)[O-])N=NC6=CC7=C(C=C(C=C7C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | DZSJSWXRTVFCNO-UHFFFAOYSA-K |
Product Overview
Diazanil Orange RR (CAS 6104-56-9), with molecular formula C41H28N7Na3O12S3 and molecular weight 975.07 g/mol. IUPAC: trisodium;7-[[4-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]benzoyl]amino]-2-methylphenyl]diazenyl]naphthalene-1,3-disulfonate.
Chemical Property Profile of Diazanil Orange RR
Property Insights of Diazanil Orange RR
The XLogP value of -1.35 indicates that Diazanil Orange RR is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 351.0 Ų indicates high polarity, suggesting Diazanil Orange RR may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diazanil Orange RR has 4 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 Diazanil Orange RR?
The CAS number of Diazanil Orange RR is 6104-56-9.
What is the molecular formula of Diazanil Orange RR?
The molecular formula of Diazanil Orange RR is C41H28N7Na3O12S3.
What is the molecular weight of Diazanil Orange RR?
The molecular weight of Diazanil Orange RR is 975.07 g/mol.
Where can I buy Diazanil Orange RR?
You can request a quote for Diazanil Orange RR directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diazanil Orange RR?
Yes, KEHONG BIO provides custom synthesis services for Diazanil Orange RR and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.