5-Acenaphthylenamine
TL;DR: 5-Acenaphthylenamine (CAS 4523-49-3) is a chemical compound with molecular formula C12H9N and molecular weight 167.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acenaphthylen-5-amine
Also Known As: acenaphthylen-5-amine, 5-ACENAPHTHYLENAMINE, J1.554.118K, RefChem:101854
| Molecular Formula | C12H9N |
|---|---|
| Molecular Weight | 167.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.0735 |
| Heavy Atoms | 13 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 4523-49-3 |
|---|---|
| SMILES | C1=CC2=C3C(=CC=C(C3=C1)N)C=C2 |
| InChIKey | NSFVUZMFCWXYKN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Acenaphthylenamine (CAS 4523-49-3), with molecular formula C12H9N and molecular weight 167.07 g/mol. IUPAC: acenaphthylen-5-amine.
Chemical Property Profile of 5-Acenaphthylenamine
Property Insights of 5-Acenaphthylenamine
The XLogP value of 3.4 indicates that 5-Acenaphthylenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 5-Acenaphthylenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acenaphthylenamine has 1 hydrogen bond donor(s) and 1 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-Acenaphthylenamine?
The CAS number of 5-Acenaphthylenamine is 4523-49-3.
What is the molecular formula of 5-Acenaphthylenamine?
The molecular formula of 5-Acenaphthylenamine is C12H9N.
What is the molecular weight of 5-Acenaphthylenamine?
The molecular weight of 5-Acenaphthylenamine is 167.07 g/mol.
Where can I buy 5-Acenaphthylenamine?
You can request a quote for 5-Acenaphthylenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acenaphthylenamine?
Yes, KEHONG BIO provides custom synthesis services for 5-Acenaphthylenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.