1,4-双(2-乙氧基羰基乙烯基)苯
TL;DR: 1,4-双(2-乙氧基羰基乙烯基)苯 (CAS 17088-28-7) is a chemical compound with molecular formula C16H18O4 and molecular weight 274.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-双(2-乙氧基羰基乙烯基)苯
ethyl 3-[4-(3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate
Also Known As: Diethyl p-benzenediacrylate, diethyl-p-phenylenediacrylate, Diethyl 1,4-Phenylenediacrylate, 1,4-Phenylenediacrylic Acid Diethyl Ester, Diethyl 3,3'-(1,4-phenylene)bisacrylate
| Molecular Formula | C16H18O4 |
|---|---|
| Molecular Weight | 274.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 274.1205 |
| Heavy Atoms | 20 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 17088-28-7 |
|---|---|
| SMILES | CCOC(=O)C=CC1=CC=C(C=C1)C=CC(=O)OCC |
| InChIKey | QYGWZBFQWUBYAT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-双(2-乙氧基羰基乙烯基)苯 (CAS 17088-28-7), with molecular formula C16H18O4 and molecular weight 274.12 g/mol. IUPAC: ethyl 3-[4-(3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate.
Chemical Property Profile of 1,4-双(2-乙氧基羰基乙烯基)苯
Property Insights of 1,4-双(2-乙氧基羰基乙烯基)苯
The XLogP value of 3.2 indicates that 1,4-双(2-乙氧基羰基乙烯基)苯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,4-双(2-乙氧基羰基乙烯基)苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-双(2-乙氧基羰基乙烯基)苯 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 1,4-双(2-乙氧基羰基乙烯基)苯?
The CAS number of 1,4-双(2-乙氧基羰基乙烯基)苯 is 17088-28-7.
What is the molecular formula of 1,4-双(2-乙氧基羰基乙烯基)苯?
The molecular formula of 1,4-双(2-乙氧基羰基乙烯基)苯 is C16H18O4.
What is the molecular weight of 1,4-双(2-乙氧基羰基乙烯基)苯?
The molecular weight of 1,4-双(2-乙氧基羰基乙烯基)苯 is 274.12 g/mol.
Where can I buy 1,4-双(2-乙氧基羰基乙烯基)苯?
You can request a quote for 1,4-双(2-乙氧基羰基乙烯基)苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-双(2-乙氧基羰基乙烯基)苯?
Yes, KEHONG BIO provides custom synthesis services for 1,4-双(2-乙氧基羰基乙烯基)苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.