Butyl 1-naphthylacetate
TL;DR: Butyl 1-naphthylacetate (CAS 34408-37-2) is a chemical compound with molecular formula C16H18O2 and molecular weight 242.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-naphthalen-1-ylacetate
Also Known As: butyl 1-naphthylacetate, butyl2-naphthalen-1-ylacetate, 1-Naphthaleneaceticacid, butyl ester, BUTYL 2-(NAPHTHALEN-1-YL)ACETATE, butyl 2-naphthalen-1-ylacetate
| Molecular Formula | C16H18O2 |
|---|---|
| Molecular Weight | 242.13 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 242.13068 |
| Heavy Atoms | 18 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 34408-37-2 |
|---|---|
| SMILES | CCCCOC(=O)CC1=CC=CC2=CC=CC=C21 |
| InChIKey | ONFNCARYSQWBPI-UHFFFAOYSA-N |
Product Overview
Butyl 1-naphthylacetate (CAS 34408-37-2), with molecular formula C16H18O2 and molecular weight 242.13 g/mol. IUPAC: butyl 2-naphthalen-1-ylacetate.
Chemical Property Profile of Butyl 1-naphthylacetate
Property Insights of Butyl 1-naphthylacetate
The XLogP value of 4.3 indicates that Butyl 1-naphthylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyl 1-naphthylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 1-naphthylacetate 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 Butyl 1-naphthylacetate?
The CAS number of Butyl 1-naphthylacetate is 34408-37-2.
What is the molecular formula of Butyl 1-naphthylacetate?
The molecular formula of Butyl 1-naphthylacetate is C16H18O2.
What is the molecular weight of Butyl 1-naphthylacetate?
The molecular weight of Butyl 1-naphthylacetate is 242.13 g/mol.
Where can I buy Butyl 1-naphthylacetate?
You can request a quote for Butyl 1-naphthylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 1-naphthylacetate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 1-naphthylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.