Diethyl 1-phenylnaphthalene-2,3-dicarboxylate
TL;DR: Diethyl 1-phenylnaphthalene-2,3-dicarboxylate (CAS 6512-57-8) is a chemical compound with molecular formula C22H20O4 and molecular weight 348.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1-phenylnaphthalene-2,3-dicarboxylate
Also Known As: diethyl 1-phenylnaphthalene-2,3-dicarboxylate, diethyl 1-phenyl-2,3-naphthalenedicarboxylate, J2.477.197K, 1-Phenylnaphthalene-2,3-dicarboxylic acid diethyl ester, 2,3-DIETHYL 1-PHENYLNAPHTHALENE-2,3-DICARBOXYLATE
| Molecular Formula | C22H20O4 |
|---|---|
| Molecular Weight | 348.14 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 348.13617 |
| Heavy Atoms | 26 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 6512-57-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=CC=CC=C2C(=C1C(=O)OCC)C3=CC=CC=C3 |
| InChIKey | VMDCGPAWPGYJSI-UHFFFAOYSA-N |
Product Overview
Diethyl 1-phenylnaphthalene-2,3-dicarboxylate (CAS 6512-57-8), with molecular formula C22H20O4 and molecular weight 348.14 g/mol. IUPAC: diethyl 1-phenylnaphthalene-2,3-dicarboxylate.
Chemical Property Profile of Diethyl 1-phenylnaphthalene-2,3-dicarboxylate
Property Insights of Diethyl 1-phenylnaphthalene-2,3-dicarboxylate
The XLogP value of 5.2 indicates that Diethyl 1-phenylnaphthalene-2,3-dicarboxylate 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 1-phenylnaphthalene-2,3-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 1-phenylnaphthalene-2,3-dicarboxylate 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 1-phenylnaphthalene-2,3-dicarboxylate?
The CAS number of Diethyl 1-phenylnaphthalene-2,3-dicarboxylate is 6512-57-8.
What is the molecular formula of Diethyl 1-phenylnaphthalene-2,3-dicarboxylate?
The molecular formula of Diethyl 1-phenylnaphthalene-2,3-dicarboxylate is C22H20O4.
What is the molecular weight of Diethyl 1-phenylnaphthalene-2,3-dicarboxylate?
The molecular weight of Diethyl 1-phenylnaphthalene-2,3-dicarboxylate is 348.14 g/mol.
Where can I buy Diethyl 1-phenylnaphthalene-2,3-dicarboxylate?
You can request a quote for Diethyl 1-phenylnaphthalene-2,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 1-phenylnaphthalene-2,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 1-phenylnaphthalene-2,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.