Diethyl 2-(pyren-4-ylmethylidene)propanedioate
TL;DR: Diethyl 2-(pyren-4-ylmethylidene)propanedioate (CAS 300679-58-7) is a chemical compound with molecular formula C24H20O4 and molecular weight 372.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(pyren-4-ylmethylidene)propanedioate
Also Known As: diethyl 2-(4-pyrenylmethylene)malonate, 1,3-Diethyl 2-(pyren-4-ylmethylidene)propanedioate, diethyl 2-(pyren-4-ylmethylidene)propanedioate, AE-018/31864035
| Molecular Formula | C24H20O4 |
|---|---|
| Molecular Weight | 372.14 g/mol |
| LogP | 5.0936 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.13617 |
| Heavy Atoms | 28 |
| Complexity | 1199.5828 |
Chemical Identifiers
| CAS Number | 300679-58-7 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3)C(=O)OCC |
Product Overview
Diethyl 2-(pyren-4-ylmethylidene)propanedioate (CAS 300679-58-7), with molecular formula C24H20O4 and molecular weight 372.14 g/mol. IUPAC: diethyl 2-(pyren-4-ylmethylidene)propanedioate.
Chemical Property Profile of Diethyl 2-(pyren-4-ylmethylidene)propanedioate
Property Insights of Diethyl 2-(pyren-4-ylmethylidene)propanedioate
The XLogP value of 5.0936 indicates that Diethyl 2-(pyren-4-ylmethylidene)propanedioate 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 2-(pyren-4-ylmethylidene)propanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 2-(pyren-4-ylmethylidene)propanedioate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethyl 2-(pyren-4-ylmethylidene)propanedioate?
The CAS number of Diethyl 2-(pyren-4-ylmethylidene)propanedioate is 300679-58-7.
What is the molecular formula of Diethyl 2-(pyren-4-ylmethylidene)propanedioate?
The molecular formula of Diethyl 2-(pyren-4-ylmethylidene)propanedioate is C24H20O4.
What is the molecular weight of Diethyl 2-(pyren-4-ylmethylidene)propanedioate?
The molecular weight of Diethyl 2-(pyren-4-ylmethylidene)propanedioate is 372.14 g/mol.
Where can I buy Diethyl 2-(pyren-4-ylmethylidene)propanedioate?
You can request a quote for Diethyl 2-(pyren-4-ylmethylidene)propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-(pyren-4-ylmethylidene)propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-(pyren-4-ylmethylidene)propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.