4-Butyloctyl phenylacetate
TL;DR: 4-Butyloctyl phenylacetate (CAS 6278-68-8) is a chemical compound with molecular formula C20H32O2 and molecular weight 304.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyloctyl 2-phenylacetate
Also Known As: 4-butyloctyl phenylacetate, 4-butyloctyl 2-phenylacetate
| Molecular Formula | C20H32O2 |
|---|---|
| Molecular Weight | 304.24 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 304.24023 |
| Heavy Atoms | 22 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 6278-68-8 |
|---|---|
| SMILES | CCCCC(CCCC)CCCOC(=O)CC1=CC=CC=C1 |
| InChIKey | ITYLRXZMXHVAGG-UHFFFAOYSA-N |
Product Overview
4-Butyloctyl phenylacetate (CAS 6278-68-8), with molecular formula C20H32O2 and molecular weight 304.24 g/mol. IUPAC: 4-butyloctyl 2-phenylacetate.
Chemical Property Profile of 4-Butyloctyl phenylacetate
Property Insights of 4-Butyloctyl phenylacetate
The XLogP value of 7.2 indicates that 4-Butyloctyl phenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Butyloctyl phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Butyloctyl phenylacetate 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 4-Butyloctyl phenylacetate?
The CAS number of 4-Butyloctyl phenylacetate is 6278-68-8.
What is the molecular formula of 4-Butyloctyl phenylacetate?
The molecular formula of 4-Butyloctyl phenylacetate is C20H32O2.
What is the molecular weight of 4-Butyloctyl phenylacetate?
The molecular weight of 4-Butyloctyl phenylacetate is 304.24 g/mol.
Where can I buy 4-Butyloctyl phenylacetate?
You can request a quote for 4-Butyloctyl phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Butyloctyl phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Butyloctyl phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.