EINECS 299-506-4
TL;DR: EINECS 299-506-4 (CAS 93892-25-2) is a chemical compound with molecular formula C26H22N4O8S2 and molecular weight 582.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[3-methyl-4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]anilino]-5-nitrobenzenesulfonic acid
Also Known As: 2-(4-((4-(((p-Tolyl)sulphonyl)oxy)-m-tolyl)azo)anilino)-5-nitrobenzenesulphonic acid, 2-({4-[(e)-(3-methyl-4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)diazenyl]phenyl}amino)-5-nitrobenzenesulfonic acid, 2-[4-[[4-[[ sulphonyl]oxy]-m-tolyl]azo]anilino]-5-nitrobenzenesulphonicacid, 2-[4-[[4-[[(p-tolyl)sulfonyl]oxy]-m-tolyl]azo]anilino]-5-nitrobenzenesulfonic acid, 2-[[4-[[3-Methyl-4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]azo]phenyl]amino]-5-nitrobenzenesulfonic acid
| Molecular Formula | C26H22N4O8S2 |
|---|---|
| Molecular Weight | 582.09 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 582.0879 |
| Heavy Atoms | 40 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 93892-25-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)N=NC3=CC=C(C=C3)NC4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)C |
| InChIKey | QOSNGQJTAXLIEU-UHFFFAOYSA-N |
Product Overview
EINECS 299-506-4 (CAS 93892-25-2), with molecular formula C26H22N4O8S2 and molecular weight 582.09 g/mol. IUPAC: 2-[4-[[3-methyl-4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]anilino]-5-nitrobenzenesulfonic acid.
Chemical Property Profile of EINECS 299-506-4
Property Insights of EINECS 299-506-4
The XLogP value of 6.2 indicates that EINECS 299-506-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 197.0 Ų indicates high polarity, suggesting EINECS 299-506-4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 299-506-4 has 2 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 EINECS 299-506-4?
The CAS number of EINECS 299-506-4 is 93892-25-2.
What is the molecular formula of EINECS 299-506-4?
The molecular formula of EINECS 299-506-4 is C26H22N4O8S2.
What is the molecular weight of EINECS 299-506-4?
The molecular weight of EINECS 299-506-4 is 582.09 g/mol.
Where can I buy EINECS 299-506-4?
You can request a quote for EINECS 299-506-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 299-506-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 299-506-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.