2-Oxo-2-phenylethyl 4-butoxybenzoate
TL;DR: 2-Oxo-2-phenylethyl 4-butoxybenzoate (CAS 306764-40-9) is a chemical compound with molecular formula C19H20O4 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 4-butoxybenzoate
Also Known As: phenacyl 4-butoxybenzoate, 2-oxo-2-phenylethyl 4-butoxybenzoate, BAS 00219775, 4-Butoxy-benzoic acid 2-oxo-2-phenyl-ethyl ester
| Molecular Formula | C19H20O4 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 3.9052 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.13617 |
| Heavy Atoms | 23 |
| Complexity | 632.179 |
Chemical Identifiers
| CAS Number | 306764-40-9 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2 |
Product Overview
2-Oxo-2-phenylethyl 4-butoxybenzoate (CAS 306764-40-9), with molecular formula C19H20O4 and molecular weight 312.14 g/mol. IUPAC: phenacyl 4-butoxybenzoate.
Chemical Property Profile of 2-Oxo-2-phenylethyl 4-butoxybenzoate
Property Insights of 2-Oxo-2-phenylethyl 4-butoxybenzoate
The XLogP value of 3.9052 indicates that 2-Oxo-2-phenylethyl 4-butoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Oxo-2-phenylethyl 4-butoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-2-phenylethyl 4-butoxybenzoate has 0 hydrogen bond donor(s) and 4 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-Oxo-2-phenylethyl 4-butoxybenzoate?
The CAS number of 2-Oxo-2-phenylethyl 4-butoxybenzoate is 306764-40-9.
What is the molecular formula of 2-Oxo-2-phenylethyl 4-butoxybenzoate?
The molecular formula of 2-Oxo-2-phenylethyl 4-butoxybenzoate is C19H20O4.
What is the molecular weight of 2-Oxo-2-phenylethyl 4-butoxybenzoate?
The molecular weight of 2-Oxo-2-phenylethyl 4-butoxybenzoate is 312.14 g/mol.
Where can I buy 2-Oxo-2-phenylethyl 4-butoxybenzoate?
You can request a quote for 2-Oxo-2-phenylethyl 4-butoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-2-phenylethyl 4-butoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-2-phenylethyl 4-butoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.