Tetramethylrhodamine-5-isothiocyanate
TL;DR: Tetramethylrhodamine-5-isothiocyanate (CAS 80724-19-2) is a chemical compound with molecular formula C25H21N3O3S and molecular weight 443.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocyanatobenzoate
Also Known As: Tetramethylrhodamine-5-isothiocyanate, 5-TRITC, Xanthylium, 5-TRITC, G isomer, HY-D0153
| Molecular Formula | C25H21N3O3S |
|---|---|
| Molecular Weight | 443.13 g/mol |
| LogP | 3.4002 |
| Topological Polar Surface Area | 71.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.13037 |
| Heavy Atoms | 32 |
| Complexity | 1459.3525 |
Chemical Identifiers
| CAS Number | 80724-19-2 |
|---|---|
| SMILES | CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=C(C=C4)N=C=S)C(=O)[O-] |
Product Overview
Tetramethylrhodamine-5-isothiocyanate (CAS 80724-19-2), with molecular formula C25H21N3O3S and molecular weight 443.13 g/mol. IUPAC: 2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocyanatobenzoate.
Chemical Property Profile of Tetramethylrhodamine-5-isothiocyanate
Property Insights of Tetramethylrhodamine-5-isothiocyanate
The XLogP value of 3.4002 indicates that Tetramethylrhodamine-5-isothiocyanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetramethylrhodamine-5-isothiocyanate. Following Lipinski's Rule of Five, Tetramethylrhodamine-5-isothiocyanate has 0 hydrogen bond donor(s) and 6 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 Tetramethylrhodamine-5-isothiocyanate?
The CAS number of Tetramethylrhodamine-5-isothiocyanate is 80724-19-2.
What is the molecular formula of Tetramethylrhodamine-5-isothiocyanate?
The molecular formula of Tetramethylrhodamine-5-isothiocyanate is C25H21N3O3S.
What is the molecular weight of Tetramethylrhodamine-5-isothiocyanate?
The molecular weight of Tetramethylrhodamine-5-isothiocyanate is 443.13 g/mol.
Where can I buy Tetramethylrhodamine-5-isothiocyanate?
You can request a quote for Tetramethylrhodamine-5-isothiocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetramethylrhodamine-5-isothiocyanate?
Yes, KEHONG BIO provides custom synthesis services for Tetramethylrhodamine-5-isothiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.