IR-140, Dye content 95 %
TL;DR: IR-140, Dye content 95 % (CAS 1201170-39-9) is a chemical compound with molecular formula C39H34Cl3N3O4S2 and molecular weight 777.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5E)-2-[(E)-2-(5-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]-5-[(2E)-2-(5-chloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]cyclopenten-1-yl]-N-phenylaniline perchlorate
Also Known As: IR-140, Dye content 95 %, IR 140, 5-chloro-2-[(1E)-2-[(3E)-3-{2-[(2Z)-5-chloro-3-ethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]ethylidene}-2-(diphenylamino)cyclopent-1-en-1-yl]ethenyl]-3-ethyl-1,3-benzothiazol-3-ium perchlorate, 5-chloro-2-(2-{3-[2-(5-chloro-3-ethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)ethylidene]-2-(diphenylamino)cyclopent-1-en-1-yl}ethenyl)-3-ethyl-1,3-benzothiazol-3-ium perchlorate, 5,5'-Dichloro-11-diphenylamino-3,3'-diethyl-10,12-ethylenethiatricarbocyanine perchlorate
| Molecular Formula | C39H34Cl3N3O4S2 |
|---|---|
| Molecular Weight | 777.11 g/mol |
| LogP | 7.0589 |
| Topological Polar Surface Area | 102.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 777.10565 |
| Heavy Atoms | 51 |
| Complexity | 2100.4712 |
Chemical Identifiers
| CAS Number | 1201170-39-9 |
|---|---|
| SMILES | CCN\1C2=C(C=CC(=C2)Cl)S/C1=C/C=C/3\CCC(=C3N(C4=CC=CC=C4)C5=CC=CC=C5)/C=C/C6=[N+](C7=C(S6)C=CC(=C7)Cl)CC.[O-]Cl(=O)(=O)=O |
Product Overview
IR-140, Dye content 95 % (CAS 1201170-39-9), with molecular formula C39H34Cl3N3O4S2 and molecular weight 777.11 g/mol. IUPAC: N-[(5E)-2-[(E)-2-(5-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]-5-[(2E)-2-(5-chloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]cyclopenten-1-yl]-N-phenylaniline perchlorate.
Chemical Property Profile of IR-140, Dye content 95 %
Property Insights of IR-140, Dye content 95 %
The XLogP value of 7.0589 indicates that IR-140, Dye content 95 % is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.6 Ų falls within the moderate polarity range, balancing permeability and solubility for IR-140, Dye content 95 %. Following Lipinski's Rule of Five, IR-140, Dye content 95 % 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 IR-140, Dye content 95 %?
The CAS number of IR-140, Dye content 95 % is 1201170-39-9.
What is the molecular formula of IR-140, Dye content 95 %?
The molecular formula of IR-140, Dye content 95 % is C39H34Cl3N3O4S2.
What is the molecular weight of IR-140, Dye content 95 %?
The molecular weight of IR-140, Dye content 95 % is 777.11 g/mol.
Where can I buy IR-140, Dye content 95 %?
You can request a quote for IR-140, Dye content 95 % directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IR-140, Dye content 95 %?
Yes, KEHONG BIO provides custom synthesis services for IR-140, Dye content 95 % and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.