![3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid structure](/static/products/4178/41789-96-2.webp)
3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid
TL;DR: 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid (CAS 41789-96-2) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-methoxyphenyl)methyl-methylamino]propanoic acid
Also Known As: 3-[(3-methoxyphenyl)methyl-methylamino]propanoic acid, N-[(3-Methoxyphenyl)methyl]-N-methyl-beta-alanine, beta-Alanine, N-[(3-methoxyphenyl)methyl]-N-methyl-
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 41789-96-2 |
|---|---|
| SMILES | CN(CCC(=O)O)CC1=CC(=CC=C1)OC |
| InChIKey | FWKALHXTNNTBPB-UHFFFAOYSA-N |
Product Overview
3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid (CAS 41789-96-2), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: 3-[(3-methoxyphenyl)methyl-methylamino]propanoic acid.
Chemical Property Profile of 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid
Property Insights of 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid
The XLogP value of -1.1 indicates that 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.8 Ų, 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid has 1 hydrogen bond donor(s) and 4 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-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid?
The CAS number of 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid is 41789-96-2.
What is the molecular formula of 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid?
The molecular formula of 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid is C12H17NO3.
What is the molecular weight of 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid?
The molecular weight of 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid is 223.12 g/mol.
Where can I buy 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid?
You can request a quote for 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-Methoxyphenyl)methyl-methylamino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.