2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
TL;DR: 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) (CAS 26536-86-7) is a chemical compound with molecular formula C9H18ClNO2 and molecular weight 207.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl prop-2-enoate;hydrochloride
Also Known As: 2-(Diethylamino)ethyl acrylate hydrochloride, 2-(Diethylamino)ethyl 2-propenoate hydrochloride, 2-diethylaminoethyl prop-2-enoate hydrochloride, 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride, 2-(diethylamino)ethyl prop-2-enoate,hydrochloride
| Molecular Formula | C9H18ClNO2 |
|---|---|
| Molecular Weight | 207.10 g/mol |
| LogP | 1.48 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 207.1026 |
| Heavy Atoms | 13 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 26536-86-7 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C=C.Cl |
| InChIKey | JIFFDTCEOLTGAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) (CAS 26536-86-7), with molecular formula C9H18ClNO2 and molecular weight 207.10 g/mol. IUPAC: 2-(diethylamino)ethyl prop-2-enoate;hydrochloride.
Chemical Property Profile of 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
Property Insights of 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
The XLogP value of 1.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1). With a topological polar surface area (TPSA) of 29.5 Ų, 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) has 1 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 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
The CAS number of 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) is 26536-86-7.
What is the molecular formula of 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
The molecular formula of 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) is C9H18ClNO2.
What is the molecular weight of 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
The molecular weight of 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) is 207.10 g/mol.
Where can I buy 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
You can request a quote for 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-(diethylamino)ethyl ester, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.