3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester
TL;DR: 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester (CAS 33545-33-4) is a chemical compound with molecular formula C20H18O4 and molecular weight 322.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,2-bis(4-methylphenyl)-5-oxofuran-3-carboxylate
Also Known As: 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester, methyl 2,2-bis(4-methylphenyl)-5-oxofuran-3-carboxylate, methyl 2,2-bis(4-methylphenyl)-5-oxo-2,5-dihydrofuran-3-carboxylate, 2,5-Dihydro-5-oxo-2,2-di(p-tolyl)-3-furancarboxylic acid methyl ester, Methyl 2,2-bis(4-methylphenyl)-5-oxo-2,5-dihydro-3-furancarboxylate #
| Molecular Formula | C20H18O4 |
|---|---|
| Molecular Weight | 322.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1205 |
| Heavy Atoms | 24 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 33545-33-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2(C(=CC(=O)O2)C(=O)OC)C3=CC=C(C=C3)C |
| InChIKey | LNNDLZYJBUUKEI-UHFFFAOYSA-N |
Product Overview
3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester (CAS 33545-33-4), with molecular formula C20H18O4 and molecular weight 322.12 g/mol. IUPAC: methyl 2,2-bis(4-methylphenyl)-5-oxofuran-3-carboxylate.
Chemical Property Profile of 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester
Property Insights of 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester
The XLogP value of 3.7 indicates that 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester 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 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester?
The CAS number of 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester is 33545-33-4.
What is the molecular formula of 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester?
The molecular formula of 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester is C20H18O4.
What is the molecular weight of 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester?
The molecular weight of 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester is 322.12 g/mol.
Where can I buy 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester?
You can request a quote for 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Furoic acid, 2,5-dihydro-5-oxo-2,2-di-p-tolyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.