Alcian yellow
TL;DR: Alcian yellow (CAS 61968-76-1) is a chemical compound with molecular formula C40H46ClN8S4+ and molecular weight 801.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[dimethylamino-[[2-[4-[[4-[5-[[dimethylamino(dimethylazaniumylidene)methyl]sulfanylmethyl]-6-methyl-1,3-benzothiazol-2-yl]phenyl]diazenyl]phenyl]-6-methyl-1,3-benzothiazol-5-yl]methylsulfanyl]methylidene]-dimethylazanium chloride
Also Known As: Alcian yellow, ALCIANYELLOW, C.I. Ingrain Yellow 1, I14-115605, [dimethylamino-[[2-[4-[[4-[5-[[dimethylamino(dimethylazaniumylidene)methyl]sulfanylmethyl]-6-methyl-1,3-benzothiazol-2-yl]phenyl]diazenyl]phenyl]-6-methyl-1,3-benzothiazol-5-yl]methylsulfanyl]methylidene]-dimethylazanium chloride
| Molecular Formula | C40H46ClN8S4+ |
|---|---|
| Molecular Weight | 801.24 g/mol |
| LogP | 7.12204 |
| Topological Polar Surface Area | 63.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 801.2417 |
| Heavy Atoms | 53 |
| Complexity | 2150.185 |
Chemical Identifiers
| CAS Number | 61968-76-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C1CSC(=[N+](C)C)N(C)C)N=C(S2)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)C5=NC6=C(S5)C=C(C(=C6)CSC(=[N+](C)C)N(C)C)C.[Cl-] |
Product Overview
Alcian yellow (CAS 61968-76-1), with molecular formula C40H46ClN8S4+ and molecular weight 801.24 g/mol. IUPAC: [dimethylamino-[[2-[4-[[4-[5-[[dimethylamino(dimethylazaniumylidene)methyl]sulfanylmethyl]-6-methyl-1,3-benzothiazol-2-yl]phenyl]diazenyl]phenyl]-6-methyl-1,3-benzothiazol-5-yl]methylsulfanyl]methylidene]-dimethylazanium chloride.
Chemical Property Profile of Alcian yellow
Property Insights of Alcian yellow
The XLogP value of 7.12204 indicates that Alcian yellow is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Alcian yellow. Following Lipinski's Rule of Five, Alcian yellow has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alcian yellow?
The CAS number of Alcian yellow is 61968-76-1.
What is the molecular formula of Alcian yellow?
The molecular formula of Alcian yellow is C40H46ClN8S4+.
What is the molecular weight of Alcian yellow?
The molecular weight of Alcian yellow is 801.24 g/mol.
Where can I buy Alcian yellow?
You can request a quote for Alcian yellow directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alcian yellow?
Yes, KEHONG BIO provides custom synthesis services for Alcian yellow and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.