2-Ethylhexyl phenylacetate
TL;DR: 2-Ethylhexyl phenylacetate (CAS 6278-62-2) is a chemical compound with molecular formula C16H24O2 and molecular weight 248.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexyl 2-phenylacetate
Also Known As: 2-Ethylhexyl phenylacetate, 2-ethylhexyl ester, 2-ethylhexyl 2-phenylacetate, 2-Ethylhexyl phenylacetate #, Phenylacetic acid, 2-ethylhexyl ester
| Molecular Formula | C16H24O2 |
|---|---|
| Molecular Weight | 248.18 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 248.17763 |
| Heavy Atoms | 18 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 6278-62-2 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)CC1=CC=CC=C1 |
| InChIKey | SRROIWIAORYOOB-UHFFFAOYSA-N |
Product Overview
2-Ethylhexyl phenylacetate (CAS 6278-62-2), with molecular formula C16H24O2 and molecular weight 248.18 g/mol. IUPAC: 2-ethylhexyl 2-phenylacetate.
Chemical Property Profile of 2-Ethylhexyl phenylacetate
Property Insights of 2-Ethylhexyl phenylacetate
The XLogP value of 5.0 indicates that 2-Ethylhexyl 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, 2-Ethylhexyl phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylhexyl phenylacetate 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 2-Ethylhexyl phenylacetate?
The CAS number of 2-Ethylhexyl phenylacetate is 6278-62-2.
What is the molecular formula of 2-Ethylhexyl phenylacetate?
The molecular formula of 2-Ethylhexyl phenylacetate is C16H24O2.
What is the molecular weight of 2-Ethylhexyl phenylacetate?
The molecular weight of 2-Ethylhexyl phenylacetate is 248.18 g/mol.
Where can I buy 2-Ethylhexyl phenylacetate?
You can request a quote for 2-Ethylhexyl phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexyl phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexyl phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.