2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester
TL;DR: 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester (CAS 20602-77-1) is a chemical compound with molecular formula C9H17NO2 and molecular weight 171.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)propyl 2-methylprop-2-enoate
Also Known As: 3-(Dimethylamino)propyl methacrylate, 3- propylmethacrylate, 3-(dimethylamino)propyl 2-methylprop-2-enoate, 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester, 3-(Dimethylamino)propylmethacrylate
| Molecular Formula | C9H17NO2 |
|---|---|
| Molecular Weight | 171.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 171.12593 |
| Heavy Atoms | 12 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 20602-77-1 |
|---|---|
| SMILES | CC(=C)C(=O)OCCCN(C)C |
| InChIKey | WWJCRUKUIQRCGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester (CAS 20602-77-1), with molecular formula C9H17NO2 and molecular weight 171.13 g/mol. IUPAC: 3-(dimethylamino)propyl 2-methylprop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester
Property Insights of 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 2-methyl-, 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, 2-methyl-, 3-(dimethylamino)propyl ester?
The CAS number of 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester is 20602-77-1.
What is the molecular formula of 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester?
The molecular formula of 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester is C9H17NO2.
What is the molecular weight of 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester?
The molecular weight of 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester is 171.13 g/mol.
Where can I buy 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester?
You can request a quote for 2-Propenoic acid, 2-methyl-, 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, 2-methyl-, 3-(dimethylamino)propyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-methyl-, 3-(dimethylamino)propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.