![Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate structure](/static/products/6773/67739-12-2.webp)
Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate
TL;DR: Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate (CAS 67739-12-2) is a chemical compound with molecular formula C23H35NO6 and molecular weight 421.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate
Also Known As: diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate, diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-forma, Diethyl [(3,5-di-tert-butyl-4-hydroxyphenyl)methyl](formamido)propanedioate, Diethyl 2-(3,5-ditert-butyl-4-hydroxybenzyl)-2-(formylamino)malonate #, Propandioic acid, 2-formalamino-2-[3,5-di-t-butyl-4-hydroxybenzyl], diethyl(ester)
| Molecular Formula | C23H35NO6 |
|---|---|
| Molecular Weight | 421.25 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 421.24643 |
| Heavy Atoms | 30 |
| Complexity | 562.0 |
Chemical Identifiers
| CAS Number | 67739-12-2 |
|---|---|
| SMILES | CCOC(=O)C(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)(C(=O)OCC)NC=O |
| InChIKey | JDGKXFLPUAJSDM-UHFFFAOYSA-N |
Product Overview
Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate (CAS 67739-12-2), with molecular formula C23H35NO6 and molecular weight 421.25 g/mol. IUPAC: diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate.
Chemical Property Profile of Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate
Property Insights of Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate
The XLogP value of 5.1 indicates that Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate. Following Lipinski's Rule of Five, Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate has 2 hydrogen bond donor(s) and 6 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-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate?
The CAS number of Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate is 67739-12-2.
What is the molecular formula of Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate?
The molecular formula of Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate is C23H35NO6.
What is the molecular weight of Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate?
The molecular weight of Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate is 421.25 g/mol.
Where can I buy Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate?
You can request a quote for Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-formamidopropanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.