3-(Dimethylamino)-2-phenylpropanoic acid
TL;DR: 3-(Dimethylamino)-2-phenylpropanoic acid (CAS 6946-81-2) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)-2-phenylpropanoic acid
Also Known As: 3-(dimethylamino)-2-phenylpropanoic acid, 3-dimethylamino-2-phenyl-propionic acid, N-(4-ethoxyphenyl)-2-methyl-1H-imidazole-4-carboxamide, RefChem:275432
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 6946-81-2 |
|---|---|
| SMILES | CN(C)CC(C1=CC=CC=C1)C(=O)O |
| InChIKey | UQKWCEMNYBVRGY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Dimethylamino)-2-phenylpropanoic acid (CAS 6946-81-2), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: 3-(dimethylamino)-2-phenylpropanoic acid.
Chemical Property Profile of 3-(Dimethylamino)-2-phenylpropanoic acid
Property Insights of 3-(Dimethylamino)-2-phenylpropanoic acid
The XLogP value of -0.8 indicates that 3-(Dimethylamino)-2-phenylpropanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, 3-(Dimethylamino)-2-phenylpropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dimethylamino)-2-phenylpropanoic acid 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 3-(Dimethylamino)-2-phenylpropanoic acid?
The CAS number of 3-(Dimethylamino)-2-phenylpropanoic acid is 6946-81-2.
What is the molecular formula of 3-(Dimethylamino)-2-phenylpropanoic acid?
The molecular formula of 3-(Dimethylamino)-2-phenylpropanoic acid is C11H15NO2.
What is the molecular weight of 3-(Dimethylamino)-2-phenylpropanoic acid?
The molecular weight of 3-(Dimethylamino)-2-phenylpropanoic acid is 193.11 g/mol.
Where can I buy 3-(Dimethylamino)-2-phenylpropanoic acid?
You can request a quote for 3-(Dimethylamino)-2-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dimethylamino)-2-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dimethylamino)-2-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.