Tetramethylene dicinnamate
TL;DR: Tetramethylene dicinnamate (CAS 7371-52-0) is a chemical compound with molecular formula C22H22O4 and molecular weight 350.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-phenylprop-2-enoyloxy)butyl 3-phenylprop-2-enoate
Also Known As: tetramethylene dicinnamate, butane-1,4-diyl bis(3-phenylprop-2-enoate), 4-(3-phenylprop-2-enoyloxy)butyl 3-phenylprop-2-enoate
| Molecular Formula | C22H22O4 |
|---|---|
| Molecular Weight | 350.15 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 350.1518 |
| Heavy Atoms | 26 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 7371-52-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC(=O)OCCCCOC(=O)C=CC2=CC=CC=C2 |
| InChIKey | OWHNFZZYMMANGT-UHFFFAOYSA-N |
Product Overview
Tetramethylene dicinnamate (CAS 7371-52-0), with molecular formula C22H22O4 and molecular weight 350.15 g/mol. IUPAC: 4-(3-phenylprop-2-enoyloxy)butyl 3-phenylprop-2-enoate.
Chemical Property Profile of Tetramethylene dicinnamate
Property Insights of Tetramethylene dicinnamate
The XLogP value of 4.9 indicates that Tetramethylene dicinnamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Tetramethylene dicinnamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetramethylene dicinnamate 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 Tetramethylene dicinnamate?
The CAS number of Tetramethylene dicinnamate is 7371-52-0.
What is the molecular formula of Tetramethylene dicinnamate?
The molecular formula of Tetramethylene dicinnamate is C22H22O4.
What is the molecular weight of Tetramethylene dicinnamate?
The molecular weight of Tetramethylene dicinnamate is 350.15 g/mol.
Where can I buy Tetramethylene dicinnamate?
You can request a quote for Tetramethylene dicinnamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetramethylene dicinnamate?
Yes, KEHONG BIO provides custom synthesis services for Tetramethylene dicinnamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.