3-Nitro-4-propoxyaniline
TL;DR: 3-Nitro-4-propoxyaniline (CAS 60569-15-5) is a chemical compound with molecular formula C9H12N2O3 and molecular weight 196.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-4-propoxyaniline
Also Known As: 3-nitro-4-propoxyaniline, 3-nitro-4-propoxyphenylamine, AO-801/41077510
| Molecular Formula | C9H12N2O3 |
|---|---|
| Molecular Weight | 196.08 g/mol |
| LogP | 1.9658 |
| Topological Polar Surface Area | 78.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.0848 |
| Heavy Atoms | 14 |
| Complexity | 338.82898 |
Chemical Identifiers
| CAS Number | 60569-15-5 |
|---|---|
| SMILES | CCCOC1=C(C=C(C=C1)N)[N+](=O)[O-] |
Product Overview
3-Nitro-4-propoxyaniline (CAS 60569-15-5), with molecular formula C9H12N2O3 and molecular weight 196.08 g/mol. IUPAC: 3-nitro-4-propoxyaniline.
Chemical Property Profile of 3-Nitro-4-propoxyaniline
Property Insights of 3-Nitro-4-propoxyaniline
The XLogP value of 1.9658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-4-propoxyaniline. The TPSA of 78.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-4-propoxyaniline. Following Lipinski's Rule of Five, 3-Nitro-4-propoxyaniline has 1 hydrogen bond donor(s) and 4 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 3-Nitro-4-propoxyaniline?
The CAS number of 3-Nitro-4-propoxyaniline is 60569-15-5.
What is the molecular formula of 3-Nitro-4-propoxyaniline?
The molecular formula of 3-Nitro-4-propoxyaniline is C9H12N2O3.
What is the molecular weight of 3-Nitro-4-propoxyaniline?
The molecular weight of 3-Nitro-4-propoxyaniline is 196.08 g/mol.
Where can I buy 3-Nitro-4-propoxyaniline?
You can request a quote for 3-Nitro-4-propoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-4-propoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-4-propoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.