Dicyanine
TL;DR: Dicyanine (CAS 52260-69-2) is a chemical compound with molecular formula C27H29IN2 and molecular weight 508.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-[3-(1-ethyl-2-methylquinolin-4-ylidene)prop-1-enyl]-4-methylquinolin-1-ium iodide
Also Known As: Dicyanine, 1-Ethyl-2-(3-(1-ethyl-2-methyl-4(1H)-quinolylidene)prop-1-enyl)-4-methylquinolinium iodide, 1-ethyl-2-[3-(1-ethyl-4(1H)-quinaldylidene)propenyl]lepidinium iodide, 1-ETHYL-2-[3-(1-ETHYL-2-METHYL-4(1H)-QUINOLYLIDENE)PROP-1-ENYL]-4-METHYLQUINOLINIUM IODIDE, 1-ethyl-2-[3-(1-ethyl-2-methylquinolin-4-ylidene)prop-1-enyl]-4-methylquinolin-1-ium iodide
| Molecular Formula | C27H29IN2 |
|---|---|
| Molecular Weight | 508.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 7.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 508.13754 |
| Heavy Atoms | 30 |
| Complexity | 645.0 |
Chemical Identifiers
| CAS Number | 52260-69-2 |
|---|---|
| SMILES | CCN1C(=CC(=CC=CC2=[N+](C3=CC=CC=C3C(=C2)C)CC)C4=CC=CC=C41)C.[I-] |
| InChIKey | PGPWDXMONHNWIC-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dicyanine (CAS 52260-69-2), with molecular formula C27H29IN2 and molecular weight 508.14 g/mol. IUPAC: 1-ethyl-2-[3-(1-ethyl-2-methylquinolin-4-ylidene)prop-1-enyl]-4-methylquinolin-1-ium iodide.
Chemical Property Profile of Dicyanine
Property Insights of Dicyanine
The XLogP value of 3.3 indicates that Dicyanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 7.1 Ų, Dicyanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dicyanine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dicyanine?
The CAS number of Dicyanine is 52260-69-2.
What is the molecular formula of Dicyanine?
The molecular formula of Dicyanine is C27H29IN2.
What is the molecular weight of Dicyanine?
The molecular weight of Dicyanine is 508.14 g/mol.
Where can I buy Dicyanine?
You can request a quote for Dicyanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dicyanine?
Yes, KEHONG BIO provides custom synthesis services for Dicyanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.