Alpha-naphthyl propionate
TL;DR: Alpha-naphthyl propionate (CAS 3121-71-9) is a chemical compound with molecular formula C13H12O2 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-1-yl propanoate
Also Known As: 1-Naphthyl propionate, Naphthalen-1-yl propionate, naphthalen-1-yl propanoate, 1-Naphthylpropionate, 1-Naphthyl propanoate
| Molecular Formula | C13H12O2 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.08372 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 3121-71-9 |
|---|---|
| SMILES | CCC(=O)OC1=CC=CC2=CC=CC=C21 |
| InChIKey | FRXPDEZCWCPLIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alpha-naphthyl propionate (CAS 3121-71-9), with molecular formula C13H12O2 and molecular weight 200.08 g/mol. IUPAC: naphthalen-1-yl propanoate.
Chemical Property Profile of Alpha-naphthyl propionate
Property Insights of Alpha-naphthyl propionate
The XLogP value of 3.3 indicates that Alpha-naphthyl propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Alpha-naphthyl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alpha-naphthyl propionate has 0 hydrogen bond donor(s) and 2 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 Alpha-naphthyl propionate?
The CAS number of Alpha-naphthyl propionate is 3121-71-9.
What is the molecular formula of Alpha-naphthyl propionate?
The molecular formula of Alpha-naphthyl propionate is C13H12O2.
What is the molecular weight of Alpha-naphthyl propionate?
The molecular weight of Alpha-naphthyl propionate is 200.08 g/mol.
Where can I buy Alpha-naphthyl propionate?
You can request a quote for Alpha-naphthyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alpha-naphthyl propionate?
Yes, KEHONG BIO provides custom synthesis services for Alpha-naphthyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.