1,1'-Diethyl-2,2'-quinotricarbocyanine iodide
TL;DR: 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide (CAS 17695-32-8) is a chemical compound with molecular formula C29H29IN2 and molecular weight 532.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-1-ethyl-2-[(2E,4E,6E)-7-(1-ethylquinolin-1-ium-2-yl)hepta-2,4,6-trienylidene]quinoline iodide
Also Known As: 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide, 1,1 inverted exclamation marka-Diethyl-2,2 inverted exclamation marka-quinotricarbocyanine iodide
| Molecular Formula | C29H29IN2 |
|---|---|
| Molecular Weight | 532.14 g/mol |
| LogP | 3.714 |
| Topological Polar Surface Area | 7.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 532.1376 |
| Heavy Atoms | 32 |
| Complexity | 1214.8088 |
Chemical Identifiers
| CAS Number | 17695-32-8 |
|---|---|
| SMILES | CCN1/C(=C\C=C\C=C\C=C\C2=[N+](C3=CC=CC=C3C=C2)CC)/C=CC4=CC=CC=C41.[I-] |
Product Overview
1,1'-Diethyl-2,2'-quinotricarbocyanine iodide (CAS 17695-32-8), with molecular formula C29H29IN2 and molecular weight 532.14 g/mol. IUPAC: (2Z)-1-ethyl-2-[(2E,4E,6E)-7-(1-ethylquinolin-1-ium-2-yl)hepta-2,4,6-trienylidene]quinoline iodide.
Chemical Property Profile of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide
Property Insights of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide
The XLogP value of 3.714 indicates that 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 7.12 Ų, 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide?
The CAS number of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide is 17695-32-8.
What is the molecular formula of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide?
The molecular formula of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide is C29H29IN2.
What is the molecular weight of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide?
The molecular weight of 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide is 532.14 g/mol.
Where can I buy 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide?
You can request a quote for 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Diethyl-2,2'-quinotricarbocyanine iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.