Hexyl 1-naphthylacetate
TL;DR: Hexyl 1-naphthylacetate (CAS 2876-73-5) is a chemical compound with molecular formula C18H22O2 and molecular weight 270.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexyl 2-naphthalen-1-ylacetate
Also Known As: Hexyl 1-naphthylacetate, Hexyl 1-naphthylacetate #, Hexyl 2-(1-naphthyl)acetate, hexyl 2-naphthalen-1-ylacetate, naphthalene-1-acetic acid hexyl ester
| Molecular Formula | C18H22O2 |
|---|---|
| Molecular Weight | 270.16 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 270.162 |
| Heavy Atoms | 20 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 2876-73-5 |
|---|---|
| SMILES | CCCCCCOC(=O)CC1=CC=CC2=CC=CC=C21 |
| InChIKey | AIRQXTVJFPUCNR-UHFFFAOYSA-N |
Product Overview
Hexyl 1-naphthylacetate (CAS 2876-73-5), with molecular formula C18H22O2 and molecular weight 270.16 g/mol. IUPAC: hexyl 2-naphthalen-1-ylacetate.
Chemical Property Profile of Hexyl 1-naphthylacetate
Property Insights of Hexyl 1-naphthylacetate
The XLogP value of 5.3 indicates that Hexyl 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, Hexyl 1-naphthylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexyl 1-naphthylacetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexyl 1-naphthylacetate?
The CAS number of Hexyl 1-naphthylacetate is 2876-73-5.
What is the molecular formula of Hexyl 1-naphthylacetate?
The molecular formula of Hexyl 1-naphthylacetate is C18H22O2.
What is the molecular weight of Hexyl 1-naphthylacetate?
The molecular weight of Hexyl 1-naphthylacetate is 270.16 g/mol.
Where can I buy Hexyl 1-naphthylacetate?
You can request a quote for Hexyl 1-naphthylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexyl 1-naphthylacetate?
Yes, KEHONG BIO provides custom synthesis services for Hexyl 1-naphthylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.