Methyl 3-morpholin-4-ylacrylate
TL;DR: Methyl 3-morpholin-4-ylacrylate (CAS 1009-80-9) is a chemical compound with molecular formula C8H13NO3 and molecular weight 171.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-morpholin-4-ylprop-2-enoate
Also Known As: Methyl (E)-3-Morpholinoacrylate, methyl 3-morpholinoacrylate, Methyl 3-morpholin-4-ylacrylate, methyl 3-morpholinoprop-2-enoate, methyl 3-morpholin-4-ylprop-2-enoate
| Molecular Formula | C8H13NO3 |
|---|---|
| Molecular Weight | 171.09 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.08954 |
| Heavy Atoms | 12 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 1009-80-9 |
|---|---|
| SMILES | COC(=O)C=CN1CCOCC1 |
| InChIKey | XFGDIQBAFODGRV-UHFFFAOYSA-N |
Product Overview
Methyl 3-morpholin-4-ylacrylate (CAS 1009-80-9), with molecular formula C8H13NO3 and molecular weight 171.09 g/mol. IUPAC: methyl 3-morpholin-4-ylprop-2-enoate.
Chemical Property Profile of Methyl 3-morpholin-4-ylacrylate
Property Insights of Methyl 3-morpholin-4-ylacrylate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-morpholin-4-ylacrylate. With a topological polar surface area (TPSA) of 38.8 Ų, Methyl 3-morpholin-4-ylacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-morpholin-4-ylacrylate 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 Methyl 3-morpholin-4-ylacrylate?
The CAS number of Methyl 3-morpholin-4-ylacrylate is 1009-80-9.
What is the molecular formula of Methyl 3-morpholin-4-ylacrylate?
The molecular formula of Methyl 3-morpholin-4-ylacrylate is C8H13NO3.
What is the molecular weight of Methyl 3-morpholin-4-ylacrylate?
The molecular weight of Methyl 3-morpholin-4-ylacrylate is 171.09 g/mol.
Where can I buy Methyl 3-morpholin-4-ylacrylate?
You can request a quote for Methyl 3-morpholin-4-ylacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-morpholin-4-ylacrylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-morpholin-4-ylacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.