(3R)-3-azaniumyl-3-(4-bromophenyl)propanoate
TL;DR: (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate (CAS 39773-47-2) is a chemical compound with molecular formula C9H10BrNO2 and molecular weight 242.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-azaniumyl-3-(4-bromophenyl)propanoate
Also Known As: dl-beta-(p-chlorophenyl)alanine, (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate
| Molecular Formula | C9H10BrNO2 |
|---|---|
| Molecular Weight | 242.99 g/mol |
| LogP | -0.1279 |
| Topological Polar Surface Area | 67.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.98949 |
| Heavy Atoms | 13 |
| Complexity | 296.98795 |
Chemical Identifiers
| CAS Number | 39773-47-2 |
|---|---|
| SMILES | C1=CC(=CC=C1[C@@H](CC(=O)[O-])[NH3+])Br |
Product Overview
(3R)-3-azaniumyl-3-(4-bromophenyl)propanoate (CAS 39773-47-2), with molecular formula C9H10BrNO2 and molecular weight 242.99 g/mol. IUPAC: (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate.
Chemical Property Profile of (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate
Property Insights of (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate
The XLogP value of -0.1279 indicates that (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate. Following Lipinski's Rule of Five, (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate has 1 hydrogen bond donor(s) and 2 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-azaniumyl-3-(4-bromophenyl)propanoate?
The CAS number of (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate is 39773-47-2.
What is the molecular formula of (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate?
The molecular formula of (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate is C9H10BrNO2.
What is the molecular weight of (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate?
The molecular weight of (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate is 242.99 g/mol.
Where can I buy (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate?
You can request a quote for (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (3R)-3-azaniumyl-3-(4-bromophenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.