Acid Blue 34 free acid
TL;DR: Acid Blue 34 free acid (CAS 25305-83-3) is a chemical compound with molecular formula C31H33N3O6S2 and molecular weight 607.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-3-[[4-(dimethylamino)phenyl]-[4-[methyl-[(3-sulfophenyl)methyl]amino]phenyl]methylidene]-6-dimethylazaniumylidenecyclohexa-1,4-diene-1-sulfonate
Also Known As: Acid Blue 34 free acid, Methanaminium, N-(4-((4-(dimethylamino)-3-sulfophenyl)(4-(methyl((3-sulfophenyl)methyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-methyl-, inner salt
| Molecular Formula | C31H33N3O6S2 |
|---|---|
| Molecular Weight | 607.18 g/mol |
| LogP | 4.1496 |
| Topological Polar Surface Area | 121.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 607.1811 |
| Heavy Atoms | 42 |
| Complexity | 1832.9047 |
Chemical Identifiers
| CAS Number | 25305-83-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C(=C\2/C=CC(=[N+](C)C)C(=C2)S(=O)(=O)[O-])/C3=CC=C(C=C3)N(C)CC4=CC(=CC=C4)S(=O)(=O)O |
Product Overview
Acid Blue 34 free acid (CAS 25305-83-3), with molecular formula C31H33N3O6S2 and molecular weight 607.18 g/mol. IUPAC: (3E)-3-[[4-(dimethylamino)phenyl]-[4-[methyl-[(3-sulfophenyl)methyl]amino]phenyl]methylidene]-6-dimethylazaniumylidenecyclohexa-1,4-diene-1-sulfonate.
Chemical Property Profile of Acid Blue 34 free acid
Property Insights of Acid Blue 34 free acid
The XLogP value of 4.1496 indicates that Acid Blue 34 free acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Acid Blue 34 free acid. Following Lipinski's Rule of Five, Acid Blue 34 free acid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acid Blue 34 free acid?
The CAS number of Acid Blue 34 free acid is 25305-83-3.
What is the molecular formula of Acid Blue 34 free acid?
The molecular formula of Acid Blue 34 free acid is C31H33N3O6S2.
What is the molecular weight of Acid Blue 34 free acid?
The molecular weight of Acid Blue 34 free acid is 607.18 g/mol.
Where can I buy Acid Blue 34 free acid?
You can request a quote for Acid Blue 34 free acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acid Blue 34 free acid?
Yes, KEHONG BIO provides custom synthesis services for Acid Blue 34 free acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.