(3R)-3-acetamido-3-phenylpropanoic acid
TL;DR: (3R)-3-acetamido-3-phenylpropanoic acid (CAS 117020-31-2) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-acetamido-3-phenylpropanoic acid
Also Known As: n-acetyl-beta-phenylalanine, (3R)-3-acetamido-3-phenylpropanoic acid, (R)-N-Acetyl-3-phenyl-beta-alanine, (R)-3-Acetylamino-3-phenylpropionic acid, (r)-n-acetyl-beta-phenyl-beta-alanine
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 117020-31-2 |
|---|---|
| SMILES | CC(=O)N[C@H](CC(=O)O)C1=CC=CC=C1 |
| InChIKey | HTWAFOFDKZAKQP-SNVBAGLBSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3R)-3-acetamido-3-phenylpropanoic acid (CAS 117020-31-2), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: (3R)-3-acetamido-3-phenylpropanoic acid.
Chemical Property Profile of (3R)-3-acetamido-3-phenylpropanoic acid
Property Insights of (3R)-3-acetamido-3-phenylpropanoic acid
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3R)-3-acetamido-3-phenylpropanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-3-acetamido-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (3R)-3-acetamido-3-phenylpropanoic acid has 2 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 (3R)-3-acetamido-3-phenylpropanoic acid?
The CAS number of (3R)-3-acetamido-3-phenylpropanoic acid is 117020-31-2.
What is the molecular formula of (3R)-3-acetamido-3-phenylpropanoic acid?
The molecular formula of (3R)-3-acetamido-3-phenylpropanoic acid is C11H13NO3.
What is the molecular weight of (3R)-3-acetamido-3-phenylpropanoic acid?
The molecular weight of (3R)-3-acetamido-3-phenylpropanoic acid is 207.09 g/mol.
Where can I buy (3R)-3-acetamido-3-phenylpropanoic acid?
You can request a quote for (3R)-3-acetamido-3-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R)-3-acetamido-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (3R)-3-acetamido-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.