Basic Red 1:1
TL;DR: Basic Red 1:1 (CAS 3068-39-1) is a chemical compound with molecular formula C27H29ClN2O3 and molecular weight 464.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)-2,7-dimethylxanthen-3-ylidene]azanium chloride
Also Known As: Basic Red 1:1, Basic Red, C.I.Basic Red 1:1, Rhodamine 590, Rhodamine 590 chloride
| Molecular Formula | C27H29ClN2O3 |
|---|---|
| Molecular Weight | 464.19 g/mol |
| LogP | 1.05 |
| Topological Polar Surface Area | 61.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.18668 |
| Heavy Atoms | 33 |
| Complexity | 807.0 |
Chemical Identifiers
| CAS Number | 3068-39-1 |
|---|---|
| SMILES | CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=CC=CC=C4C(=O)OC.[Cl-] |
| InChIKey | GOVUVIWZMYRXMY-UHFFFAOYSA-N |
Product Overview
Basic Red 1:1 (CAS 3068-39-1), with molecular formula C27H29ClN2O3 and molecular weight 464.19 g/mol. IUPAC: ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)-2,7-dimethylxanthen-3-ylidene]azanium chloride.
Chemical Property Profile of Basic Red 1:1
Property Insights of Basic Red 1:1
The XLogP value of 1.05 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Basic Red 1:1. The TPSA of 61.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Basic Red 1:1. Following Lipinski's Rule of Five, Basic Red 1:1 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Basic Red 1:1?
The CAS number of Basic Red 1:1 is 3068-39-1.
What is the molecular formula of Basic Red 1:1?
The molecular formula of Basic Red 1:1 is C27H29ClN2O3.
What is the molecular weight of Basic Red 1:1?
The molecular weight of Basic Red 1:1 is 464.19 g/mol.
Where can I buy Basic Red 1:1?
You can request a quote for Basic Red 1:1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Basic Red 1:1?
Yes, KEHONG BIO provides custom synthesis services for Basic Red 1:1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.