Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)
TL;DR: Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) (CAS 67801-02-9) is a chemical compound with molecular formula C34H24CaCl2N4O8S2 and molecular weight 790.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(4-chloro-2-[(2-hydroxynaphthalen-1-yl)diazenyl]-5-methylbenzenesulfonate)
Also Known As: C17H13ClN2O4S.1/2Ca, C17-H13-Cl-N2-O4-S.1/2Ca, Benzenesulfonic acid, 4-chloro-2-((2-hydroxy-1-naphthalenyl)azo)-5-methyl-, calcium salt (2:1), Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate), 4-Chloro-5-methyl-2-((2-hydroxy-1-naphthyl)azo)-1-benzenesulfonic acid, calcium salt
| Molecular Formula | C34H24CaCl2N4O8S2 |
|---|---|
| Molecular Weight | 790.00 g/mol |
| LogP | 9.27 |
| Topological Polar Surface Area | 221.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 790.00385 |
| Heavy Atoms | 51 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 67801-02-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)N=NC2=C(C=CC3=CC=CC=C32)O)S(=O)(=O)[O-].CC1=CC(=C(C=C1Cl)N=NC2=C(C=CC3=CC=CC=C32)O)S(=O)(=O)[O-].[Ca+2] |
| InChIKey | FEMQUTBNUMVBBI-UHFFFAOYSA-L |
Product Overview
Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) (CAS 67801-02-9), with molecular formula C34H24CaCl2N4O8S2 and molecular weight 790.00 g/mol. IUPAC: calcium bis(4-chloro-2-[(2-hydroxynaphthalen-1-yl)diazenyl]-5-methylbenzenesulfonate).
Chemical Property Profile of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)
Property Insights of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)
The XLogP value of 9.27 indicates that Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 221.0 Ų indicates high polarity, suggesting Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)?
The CAS number of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) is 67801-02-9.
What is the molecular formula of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)?
The molecular formula of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) is C34H24CaCl2N4O8S2.
What is the molecular weight of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)?
The molecular weight of Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) is 790.00 g/mol.
Where can I buy Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)?
You can request a quote for Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate)?
Yes, KEHONG BIO provides custom synthesis services for Calcium bis(6-chloro-4-((2-hydroxy-1-naphthyl)azo)toluene-3-sulphonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.