2-Propenoic acid, 3-(dimethylamino)propyl ester
TL;DR: 2-Propenoic acid, 3-(dimethylamino)propyl ester (CAS 18526-07-3) is a chemical compound with molecular formula C8H15NO2 and molecular weight 157.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)propyl prop-2-enoate
Also Known As: 3-(Dimethylamino)propyl acrylate, 3-(dimethylamino)propyl prop-2-enoate, 3-(n,n-dimethylamino)propyl acrylate, 2-Propenoic acid, 3-(dimethylamino)propyl ester, 3-(Dimethylamino)propyl acrylate, 95%
| Molecular Formula | C8H15NO2 |
|---|---|
| Molecular Weight | 157.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 157.11028 |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 18526-07-3 |
|---|---|
| SMILES | CN(C)CCCOC(=O)C=C |
| InChIKey | UFQHFMGRRVQFNA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenoic acid, 3-(dimethylamino)propyl ester (CAS 18526-07-3), with molecular formula C8H15NO2 and molecular weight 157.11 g/mol. IUPAC: 3-(dimethylamino)propyl prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 3-(dimethylamino)propyl ester
Property Insights of 2-Propenoic acid, 3-(dimethylamino)propyl ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 3-(dimethylamino)propyl ester. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Propenoic acid, 3-(dimethylamino)propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-(dimethylamino)propyl ester 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 2-Propenoic acid, 3-(dimethylamino)propyl ester?
The CAS number of 2-Propenoic acid, 3-(dimethylamino)propyl ester is 18526-07-3.
What is the molecular formula of 2-Propenoic acid, 3-(dimethylamino)propyl ester?
The molecular formula of 2-Propenoic acid, 3-(dimethylamino)propyl ester is C8H15NO2.
What is the molecular weight of 2-Propenoic acid, 3-(dimethylamino)propyl ester?
The molecular weight of 2-Propenoic acid, 3-(dimethylamino)propyl ester is 157.11 g/mol.
Where can I buy 2-Propenoic acid, 3-(dimethylamino)propyl ester?
You can request a quote for 2-Propenoic acid, 3-(dimethylamino)propyl ester 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, 3-(dimethylamino)propyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-(dimethylamino)propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.