(E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile
TL;DR: (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile (CAS 57988-65-5) is a chemical compound with molecular formula C8H12N2O and molecular weight 152.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile
Also Known As: 2-Propenenitrile,2-methyl-3- -, -, 2-methyl-3-morpholin-4-yl-prop-2-enenitrile, (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile, 2-Propenenitrile, 2-methyl-3-(4-morpholinyl)-, (E)- (9CI)
| Molecular Formula | C8H12N2O |
|---|---|
| Molecular Weight | 152.09 g/mol |
| LogP | 0.74598 |
| Topological Polar Surface Area | 36.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.09496 |
| Heavy Atoms | 11 |
| Complexity | 186.75896 |
Chemical Identifiers
| CAS Number | 57988-65-5 |
|---|---|
| SMILES | C/C(=C\N1CCOCC1)/C#N |
Product Overview
(E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile (CAS 57988-65-5), with molecular formula C8H12N2O and molecular weight 152.09 g/mol. IUPAC: (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile.
Chemical Property Profile of (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile
Property Insights of (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile
The XLogP value of 0.74598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile. With a topological polar surface area (TPSA) of 36.26 Ų, (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile has 0 hydrogen bond donor(s) and 3 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 (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile?
The CAS number of (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile is 57988-65-5.
What is the molecular formula of (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile?
The molecular formula of (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile is C8H12N2O.
What is the molecular weight of (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile?
The molecular weight of (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile is 152.09 g/mol.
Where can I buy (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile?
You can request a quote for (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-methyl-3-morpholin-4-ylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.