(2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile
TL;DR: (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile (CAS 1164525-08-9) is a chemical compound with molecular formula C13H14N2O and molecular weight 214.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-morpholin-4-yl-2-phenylprop-2-enenitrile
Also Known As: (E)-2-Phenyl-3-morpholinoacrylonitrile, (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile, 2-Phenyl-3-morpholinoacrylonitrile, 3-morpholino-2-phenylacrylonitrile, (E)-3-morpholino-2-phenylacrylonitrile
| Molecular Formula | C13H14N2O |
|---|---|
| Molecular Weight | 214.11 g/mol |
| LogP | 1.88328 |
| Topological Polar Surface Area | 36.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.11061 |
| Heavy Atoms | 16 |
| Complexity | 399.69083 |
Chemical Identifiers
| CAS Number | 1164525-08-9 |
|---|---|
| SMILES | C1COCCN1/C=C(/C#N)\C2=CC=CC=C2 |
Product Overview
(2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile (CAS 1164525-08-9), with molecular formula C13H14N2O and molecular weight 214.11 g/mol. IUPAC: (E)-3-morpholin-4-yl-2-phenylprop-2-enenitrile.
Chemical Property Profile of (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile
Property Insights of (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile
The XLogP value of 1.88328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile. With a topological polar surface area (TPSA) of 36.26 Ų, (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-(morpholin-4-yl)-2-phenylprop-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 (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile?
The CAS number of (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile is 1164525-08-9.
What is the molecular formula of (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile?
The molecular formula of (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile is C13H14N2O.
What is the molecular weight of (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile?
The molecular weight of (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile is 214.11 g/mol.
Where can I buy (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile?
You can request a quote for (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(morpholin-4-yl)-2-phenylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.