茜素黃R
TL;DR: 茜素黃R (CAS 2243-76-7) is a chemical compound with molecular formula C13H9N3O5 and molecular weight 287.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
茜素黃R
2-hydroxy-5-[(4-nitrophenyl)diazenyl]benzoic acid
Also Known As: Alizarine Yellow R, Mordant Orange 1, Alizarin Yellow R, Pnbas, Chrome Orange R
| Molecular Formula | C13H9N3O5 |
|---|---|
| Molecular Weight | 287.05 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.05423 |
| Heavy Atoms | 21 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 2243-76-7 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NC2=CC(=C(C=C2)O)C(=O)O)[N+](=O)[O-] |
| InChIKey | YVJPMMYYRNHJAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
茜素黃R (CAS 2243-76-7), with molecular formula C13H9N3O5 and molecular weight 287.05 g/mol. IUPAC: 2-hydroxy-5-[(4-nitrophenyl)diazenyl]benzoic acid.
Chemical Property Profile of 茜素黃R
Property Insights of 茜素黃R
The XLogP value of 4.1 indicates that 茜素黃R is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 茜素黃R. Following Lipinski's Rule of Five, 茜素黃R has 2 hydrogen bond donor(s) and 7 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 茜素黃R?
The CAS number of 茜素黃R is 2243-76-7.
What is the molecular formula of 茜素黃R?
The molecular formula of 茜素黃R is C13H9N3O5.
What is the molecular weight of 茜素黃R?
The molecular weight of 茜素黃R is 287.05 g/mol.
Where can I buy 茜素黃R?
You can request a quote for 茜素黃R directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 茜素黃R?
Yes, KEHONG BIO provides custom synthesis services for 茜素黃R and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.