EINECS 231-003-7
TL;DR: EINECS 231-003-7 (CAS 7401-69-6) is a chemical compound with molecular formula C22H16N4O10S3 and molecular weight 592.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-8-[[4-[(4-sulfophenyl)diazenyl]phenyl]diazenyl]naphthalene-1,3-disulfonic acid
Also Known As: EINECS 231-003-7, Trisodium 7-hydroxy-8-((4-((4-sulphonatophenyl)azo)phenyl)azo)naphthalene-1,3-disulphonate, 7-oxo-8-[[4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-1,3-disulfonic acid, Trisodium 7-hydroxy-8-[[4-[(4-sulfonatophenyl)azo]phenyl]azo]naphthalene-1,3-disulfonate, (8Z)-7-oxo-8-[[4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-1,3-disulfonic acid
| Molecular Formula | C22H16N4O10S3 |
|---|---|
| Molecular Weight | 592.00 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 258.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 592.00287 |
| Heavy Atoms | 39 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 7401-69-6 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)N=NC3=C(C=CC4=CC(=CC(=C43)S(=O)(=O)O)S(=O)(=O)O)O |
| InChIKey | MKOJHJCFYCSSJX-UHFFFAOYSA-N |
Product Overview
EINECS 231-003-7 (CAS 7401-69-6), with molecular formula C22H16N4O10S3 and molecular weight 592.00 g/mol. IUPAC: 7-hydroxy-8-[[4-[(4-sulfophenyl)diazenyl]phenyl]diazenyl]naphthalene-1,3-disulfonic acid.
Chemical Property Profile of EINECS 231-003-7
Property Insights of EINECS 231-003-7
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 231-003-7. The TPSA of 258.0 Ų indicates high polarity, suggesting EINECS 231-003-7 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 231-003-7 has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 231-003-7?
The CAS number of EINECS 231-003-7 is 7401-69-6.
What is the molecular formula of EINECS 231-003-7?
The molecular formula of EINECS 231-003-7 is C22H16N4O10S3.
What is the molecular weight of EINECS 231-003-7?
The molecular weight of EINECS 231-003-7 is 592.00 g/mol.
Where can I buy EINECS 231-003-7?
You can request a quote for EINECS 231-003-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 231-003-7?
Yes, KEHONG BIO provides custom synthesis services for EINECS 231-003-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.