7-Aminocoumarin
TL;DR: 7-Aminocoumarin (CAS 94240-17-2) is a chemical compound with molecular formula C9H7NO2 and molecular weight 161.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-aminochromen-2-one
Also Known As: 7-Aminocoumarin, 7-amino-2h-chromen-2-one, 7-aminochromen-2-one, 7-amino coumarin, 7-Amino-2H-1-benzopyran-2-one
| Molecular Formula | C9H7NO2 |
|---|---|
| Molecular Weight | 161.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.04768 |
| Heavy Atoms | 12 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 94240-17-2 |
|---|---|
| SMILES | C1=CC(=CC2=C1C=CC(=O)O2)N |
| InChIKey | RRHXPUCIXLAHIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Aminocoumarin (CAS 94240-17-2), with molecular formula C9H7NO2 and molecular weight 161.05 g/mol. IUPAC: 7-aminochromen-2-one.
Chemical Property Profile of 7-Aminocoumarin
Property Insights of 7-Aminocoumarin
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Aminocoumarin. With a topological polar surface area (TPSA) of 52.3 Ų, 7-Aminocoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Aminocoumarin has 1 hydrogen bond donor(s) and 3 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 7-Aminocoumarin?
The CAS number of 7-Aminocoumarin is 94240-17-2.
What is the molecular formula of 7-Aminocoumarin?
The molecular formula of 7-Aminocoumarin is C9H7NO2.
What is the molecular weight of 7-Aminocoumarin?
The molecular weight of 7-Aminocoumarin is 161.05 g/mol.
Where can I buy 7-Aminocoumarin?
You can request a quote for 7-Aminocoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Aminocoumarin?
Yes, KEHONG BIO provides custom synthesis services for 7-Aminocoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.