Diethyl 3,4-diphenylhexanedioate
TL;DR: Diethyl 3,4-diphenylhexanedioate (CAS 19449-94-6) is a chemical compound with molecular formula C22H26O4 and molecular weight 354.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 3,4-diphenylhexanedioate
Also Known As: Diethyl 3,4-diphenylhexanedioate, 1,6-Diethyl 3,4-diphenylhexanedioate, 3,4-Diphenyladipic acid diethyl ester, 3,4-Diphenylhexanedioic acid diethyl ester
| Molecular Formula | C22H26O4 |
|---|---|
| Molecular Weight | 354.18 g/mol |
| LogP | 4.4604 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 354.1831 |
| Heavy Atoms | 26 |
| Complexity | 620.30316 |
Chemical Identifiers
| CAS Number | 19449-94-6 |
|---|---|
| SMILES | CCOC(=O)CC(C1=CC=CC=C1)C(CC(=O)OCC)C2=CC=CC=C2 |
Product Overview
Diethyl 3,4-diphenylhexanedioate (CAS 19449-94-6), with molecular formula C22H26O4 and molecular weight 354.18 g/mol. IUPAC: diethyl 3,4-diphenylhexanedioate.
Chemical Property Profile of Diethyl 3,4-diphenylhexanedioate
Property Insights of Diethyl 3,4-diphenylhexanedioate
The XLogP value of 4.4604 indicates that Diethyl 3,4-diphenylhexanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diethyl 3,4-diphenylhexanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 3,4-diphenylhexanedioate 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 Diethyl 3,4-diphenylhexanedioate?
The CAS number of Diethyl 3,4-diphenylhexanedioate is 19449-94-6.
What is the molecular formula of Diethyl 3,4-diphenylhexanedioate?
The molecular formula of Diethyl 3,4-diphenylhexanedioate is C22H26O4.
What is the molecular weight of Diethyl 3,4-diphenylhexanedioate?
The molecular weight of Diethyl 3,4-diphenylhexanedioate is 354.18 g/mol.
Where can I buy Diethyl 3,4-diphenylhexanedioate?
You can request a quote for Diethyl 3,4-diphenylhexanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 3,4-diphenylhexanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 3,4-diphenylhexanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.