EINECS 271-936-7
TL;DR: EINECS 271-936-7 (CAS 68631-11-8) is a chemical compound with molecular formula C17H12ClN3Na2O7S2 and molecular weight 514.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;7-amino-8-[(5-chloro-4-methyl-2-sulfonatophenyl)diazenyl]-4-hydroxynaphthalene-2-sulfonate
Also Known As: 2-Naphthalenesulfonic acid, 6-amino-5-[(5-chloro-4-methyl-2-sulfophenyl)azo]-4-hydroxy-, disodium salt, Disodium 6-amino-5-((5-chloro-4-methyl-2-sulphonatophenyl)azo)-4-hydroxynaphthalene-2-sulphonate, 2-Naphthalenesulfonic acid, 6-amino-5-((5-chloro-4-methyl-2-sulfophenyl)azo)-4-hydroxy-, disodium salt, 2-Naphthalenesulfonic acid, 6-amino-5-(2-(5-chloro-4-methyl-2-sulfophenyl)diazenyl)-4-hydroxy-, sodium salt (1:2), Disodium 6-amino-5-[(5-chloro-4-methyl-2-sulfonatophenyl)azo]-4-hydroxynaphthalene-2-sulfonate
| Molecular Formula | C17H12ClN3Na2O7S2 |
|---|---|
| Molecular Weight | 514.96 g/mol |
| LogP | -2.68 |
| Topological Polar Surface Area | 202.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 514.9601 |
| Heavy Atoms | 32 |
| Complexity | 831.0 |
Chemical Identifiers
| CAS Number | 68631-11-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)N=NC2=C(C=CC3=C2C=C(C=C3O)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | QOHDMCNGVVUPJW-UHFFFAOYSA-L |
Product Overview
EINECS 271-936-7 (CAS 68631-11-8), with molecular formula C17H12ClN3Na2O7S2 and molecular weight 514.96 g/mol. IUPAC: disodium;7-amino-8-[(5-chloro-4-methyl-2-sulfonatophenyl)diazenyl]-4-hydroxynaphthalene-2-sulfonate.
Chemical Property Profile of EINECS 271-936-7
Property Insights of EINECS 271-936-7
The XLogP value of -2.68 indicates that EINECS 271-936-7 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 202.0 Ų indicates high polarity, suggesting EINECS 271-936-7 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 271-936-7 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 271-936-7?
The CAS number of EINECS 271-936-7 is 68631-11-8.
What is the molecular formula of EINECS 271-936-7?
The molecular formula of EINECS 271-936-7 is C17H12ClN3Na2O7S2.
What is the molecular weight of EINECS 271-936-7?
The molecular weight of EINECS 271-936-7 is 514.96 g/mol.
Where can I buy EINECS 271-936-7?
You can request a quote for EINECS 271-936-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 271-936-7?
Yes, KEHONG BIO provides custom synthesis services for EINECS 271-936-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.