{5-Nitro-2-propoxyanilino}acetic acid
TL;DR: {5-Nitro-2-propoxyanilino}acetic acid (CAS 342044-67-1) is a chemical compound with molecular formula C11H14N2O5 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-nitro-2-propoxyanilino)acetic acid
Also Known As: {5-nitro-2-propoxyanilino}acetic acid, 2-(5-nitro-2-propoxyanilino)acetic acid, AE-562/12222479
| Molecular Formula | C11H14N2O5 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 1.8801 |
| Topological Polar Surface Area | 101.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 254.09027 |
| Heavy Atoms | 18 |
| Complexity | 447.05975 |
Chemical Identifiers
| CAS Number | 342044-67-1 |
|---|---|
| SMILES | CCCOC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)O |
Product Overview
{5-Nitro-2-propoxyanilino}acetic acid (CAS 342044-67-1), with molecular formula C11H14N2O5 and molecular weight 254.09 g/mol. IUPAC: 2-(5-nitro-2-propoxyanilino)acetic acid.
Chemical Property Profile of {5-Nitro-2-propoxyanilino}acetic acid
Property Insights of {5-Nitro-2-propoxyanilino}acetic acid
The XLogP value of 1.8801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {5-Nitro-2-propoxyanilino}acetic acid. The TPSA of 101.7 Ų falls within the moderate polarity range, balancing permeability and solubility for {5-Nitro-2-propoxyanilino}acetic acid. Following Lipinski's Rule of Five, {5-Nitro-2-propoxyanilino}acetic acid 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 {5-Nitro-2-propoxyanilino}acetic acid?
The CAS number of {5-Nitro-2-propoxyanilino}acetic acid is 342044-67-1.
What is the molecular formula of {5-Nitro-2-propoxyanilino}acetic acid?
The molecular formula of {5-Nitro-2-propoxyanilino}acetic acid is C11H14N2O5.
What is the molecular weight of {5-Nitro-2-propoxyanilino}acetic acid?
The molecular weight of {5-Nitro-2-propoxyanilino}acetic acid is 254.09 g/mol.
Where can I buy {5-Nitro-2-propoxyanilino}acetic acid?
You can request a quote for {5-Nitro-2-propoxyanilino}acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {5-Nitro-2-propoxyanilino}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for {5-Nitro-2-propoxyanilino}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.