2-(2-Formyl-4-nitrophenoxy)acetic acid
TL;DR: 2-(2-Formyl-4-nitrophenoxy)acetic acid (CAS 884-68-4) is a chemical compound with molecular formula C9H7NO6 and molecular weight 225.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-formyl-4-nitrophenoxy)acetic acid
Also Known As: 2-Formyl-4-nitrophenoxyacetic acid, 2-(2-formyl-4-nitrophenoxy)acetic acid, (2-formyl-4-nitrophenoxy)acetic acid, Acetic acid,2-(2-formyl-4-nitrophenoxy)-, KST-1A8714
| Molecular Formula | C9H7NO6 |
|---|---|
| Molecular Weight | 225.03 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.02734 |
| Heavy Atoms | 16 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 884-68-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C=O)OCC(=O)O |
| InChIKey | SQXGTZOQJSQCPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Formyl-4-nitrophenoxy)acetic acid (CAS 884-68-4), with molecular formula C9H7NO6 and molecular weight 225.03 g/mol. IUPAC: 2-(2-formyl-4-nitrophenoxy)acetic acid.
Chemical Property Profile of 2-(2-Formyl-4-nitrophenoxy)acetic acid
Property Insights of 2-(2-Formyl-4-nitrophenoxy)acetic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Formyl-4-nitrophenoxy)acetic acid. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Formyl-4-nitrophenoxy)acetic acid. Following Lipinski's Rule of Five, 2-(2-Formyl-4-nitrophenoxy)acetic acid has 1 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 2-(2-Formyl-4-nitrophenoxy)acetic acid?
The CAS number of 2-(2-Formyl-4-nitrophenoxy)acetic acid is 884-68-4.
What is the molecular formula of 2-(2-Formyl-4-nitrophenoxy)acetic acid?
The molecular formula of 2-(2-Formyl-4-nitrophenoxy)acetic acid is C9H7NO6.
What is the molecular weight of 2-(2-Formyl-4-nitrophenoxy)acetic acid?
The molecular weight of 2-(2-Formyl-4-nitrophenoxy)acetic acid is 225.03 g/mol.
Where can I buy 2-(2-Formyl-4-nitrophenoxy)acetic acid?
You can request a quote for 2-(2-Formyl-4-nitrophenoxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Formyl-4-nitrophenoxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Formyl-4-nitrophenoxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.