![dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate structure](/static/products/329/329688-27-9.png)
dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate
TL;DR: dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate (CAS 329688-27-9) is a chemical compound with molecular formula C12H17NO5 and molecular weight 255.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(E)-3-morpholin-4-ylprop-2-enylidene]propanedioate
Also Known As: (E)-dimethyl 2-(3-morpholinoallylidene)malonate, dimethyl [3-(4-morpholinyl)-2-propen-1-ylidene]malonate, Dimethyl 2-(3-morpholin-4-ylprop-2-enylidene)propanedioate, 2-((E)-3-Morpholin-4-yl-allylidene)-malonic acid dimethyl ester, dimethyl 2-[(E)-3-morpholin-4-ylprop-2-enylidene]propanedioate
| Molecular Formula | C12H17NO5 |
|---|---|
| Molecular Weight | 255.11 g/mol |
| LogP | 0.1047 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.11067 |
| Heavy Atoms | 18 |
| Complexity | 337.47928 |
Chemical Identifiers
| CAS Number | 329688-27-9 |
|---|---|
| SMILES | COC(=O)C(=C/C=C/N1CCOCC1)C(=O)OC |
Product Overview
dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate (CAS 329688-27-9), with molecular formula C12H17NO5 and molecular weight 255.11 g/mol. IUPAC: dimethyl 2-[(E)-3-morpholin-4-ylprop-2-enylidene]propanedioate.
Chemical Property Profile of dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate
Property Insights of dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate
The XLogP value of 0.1047 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate. The TPSA of 65.07 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate. Following Lipinski's Rule of Five, dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate 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 dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate?
The CAS number of dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate is 329688-27-9.
What is the molecular formula of dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate?
The molecular formula of dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate is C12H17NO5.
What is the molecular weight of dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate?
The molecular weight of dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate is 255.11 g/mol.
Where can I buy dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate?
You can request a quote for dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl [(2E)-3-(morpholin-4-yl)prop-2-en-1-ylidene]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.