4-(Diethylamino)cinnamaldehyde
TL;DR: 4-(Diethylamino)cinnamaldehyde (CAS 194099-39-3) is a chemical compound with molecular formula C13H17NO and molecular weight 203.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(diethylamino)phenyl]prop-2-enal
Also Known As: 4-(diethylamino)cinnamaldehyde, p-diethylaminocinnamaldehyde, trans-4-(Diethylamino)cinnamaldehyde, 3-[4-(diethylamino)phenyl]prop-2-enal, 2-Propenal,3-[4-(diethylamino)phenyl]-
| Molecular Formula | C13H17NO |
|---|---|
| Molecular Weight | 203.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 203.13101 |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 194099-39-3 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C=CC=O |
| InChIKey | JXXOTBSUZDDHLT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Diethylamino)cinnamaldehyde (CAS 194099-39-3), with molecular formula C13H17NO and molecular weight 203.13 g/mol. IUPAC: 3-[4-(diethylamino)phenyl]prop-2-enal.
Chemical Property Profile of 4-(Diethylamino)cinnamaldehyde
Property Insights of 4-(Diethylamino)cinnamaldehyde
The XLogP value of 3.1 indicates that 4-(Diethylamino)cinnamaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 4-(Diethylamino)cinnamaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Diethylamino)cinnamaldehyde has 0 hydrogen bond donor(s) and 2 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 4-(Diethylamino)cinnamaldehyde?
The CAS number of 4-(Diethylamino)cinnamaldehyde is 194099-39-3.
What is the molecular formula of 4-(Diethylamino)cinnamaldehyde?
The molecular formula of 4-(Diethylamino)cinnamaldehyde is C13H17NO.
What is the molecular weight of 4-(Diethylamino)cinnamaldehyde?
The molecular weight of 4-(Diethylamino)cinnamaldehyde is 203.13 g/mol.
Where can I buy 4-(Diethylamino)cinnamaldehyde?
You can request a quote for 4-(Diethylamino)cinnamaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Diethylamino)cinnamaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(Diethylamino)cinnamaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.