![1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate structure](/static/products/4778/477858-64-3.webp)
1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate
TL;DR: 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate (CAS 477858-64-3) is a chemical compound with molecular formula C11H17NO5 and molecular weight 243.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate
Also Known As: dimethyl 2-[(E)-3-(dimethylamino)-2-propenoyl]succinate, 1,4-dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate, dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate
| Molecular Formula | C11H17NO5 |
|---|---|
| Molecular Weight | 243.11 g/mol |
| LogP | -0.0169 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 243.11067 |
| Heavy Atoms | 17 |
| Complexity | 321.8235 |
Chemical Identifiers
| CAS Number | 477858-64-3 |
|---|---|
| SMILES | CN(C)C=CC(=O)C(CC(=O)OC)C(=O)OC |
Product Overview
1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate (CAS 477858-64-3), with molecular formula C11H17NO5 and molecular weight 243.11 g/mol. IUPAC: dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate.
Chemical Property Profile of 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate
Property Insights of 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate
The XLogP value of -0.0169 indicates that 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate. Following Lipinski's Rule of Five, 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate has 0 hydrogen bond donor(s) and 6 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-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate?
The CAS number of 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate is 477858-64-3.
What is the molecular formula of 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate?
The molecular formula of 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate is C11H17NO5.
What is the molecular weight of 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate?
The molecular weight of 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate is 243.11 g/mol.
Where can I buy 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate?
You can request a quote for 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimethyl 2-[3-(dimethylamino)prop-2-enoyl]butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.