Ethyl 3,4-diphenylbutanoate
TL;DR: Ethyl 3,4-diphenylbutanoate (CAS 72277-18-0) is a chemical compound with molecular formula C18H20O2 and molecular weight 268.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,4-diphenylbutanoate
Also Known As: Ethyl 3,4-diphenylbutanoate
| Molecular Formula | C18H20O2 |
|---|---|
| Molecular Weight | 268.15 g/mol |
| LogP | 3.9661 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 268.14633 |
| Heavy Atoms | 20 |
| Complexity | 519.6292 |
Chemical Identifiers
| CAS Number | 72277-18-0 |
|---|---|
| SMILES | CCOC(=O)CC(CC1=CC=CC=C1)C2=CC=CC=C2 |
Product Overview
Ethyl 3,4-diphenylbutanoate (CAS 72277-18-0), with molecular formula C18H20O2 and molecular weight 268.15 g/mol. IUPAC: ethyl 3,4-diphenylbutanoate.
Chemical Property Profile of Ethyl 3,4-diphenylbutanoate
Property Insights of Ethyl 3,4-diphenylbutanoate
The XLogP value of 3.9661 indicates that Ethyl 3,4-diphenylbutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 3,4-diphenylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3,4-diphenylbutanoate 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 Ethyl 3,4-diphenylbutanoate?
The CAS number of Ethyl 3,4-diphenylbutanoate is 72277-18-0.
What is the molecular formula of Ethyl 3,4-diphenylbutanoate?
The molecular formula of Ethyl 3,4-diphenylbutanoate is C18H20O2.
What is the molecular weight of Ethyl 3,4-diphenylbutanoate?
The molecular weight of Ethyl 3,4-diphenylbutanoate is 268.15 g/mol.
Where can I buy Ethyl 3,4-diphenylbutanoate?
You can request a quote for Ethyl 3,4-diphenylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3,4-diphenylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3,4-diphenylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.