(s)-3-Amino-3-(4-nitrophenyl)propanoic acid
TL;DR: (s)-3-Amino-3-(4-nitrophenyl)propanoic acid (CAS 501030-96-2) is a chemical compound with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-3-(4-nitrophenyl)propanoic acid
Also Known As: (s)-3-amino-3-(4-nitrophenyl)propanoic acid, (3S)-3-amino-3-(4-nitrophenyl)propanoic acid, (s)-3-(p-nitrophenyl)-beta-alanine, h-beta-phe(4-no2)-oh, (s)-beta-(p-nitrophenyl)alanine
| Molecular Formula | C9H10N2O4 |
|---|---|
| Molecular Weight | 210.06 g/mol |
| LogP | 1.0693 |
| Topological Polar Surface Area | 106.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.06406 |
| Heavy Atoms | 15 |
| Complexity | 374.20367 |
Chemical Identifiers
| CAS Number | 501030-96-2 |
|---|---|
| SMILES | C1=CC(=CC=C1[C@H](CC(=O)O)N)[N+](=O)[O-] |
Product Overview
(s)-3-Amino-3-(4-nitrophenyl)propanoic acid (CAS 501030-96-2), with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol. IUPAC: (3S)-3-amino-3-(4-nitrophenyl)propanoic acid.
Chemical Property Profile of (s)-3-Amino-3-(4-nitrophenyl)propanoic acid
Property Insights of (s)-3-Amino-3-(4-nitrophenyl)propanoic acid
The XLogP value of 1.0693 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (s)-3-Amino-3-(4-nitrophenyl)propanoic acid. The TPSA of 106.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (s)-3-Amino-3-(4-nitrophenyl)propanoic acid. Following Lipinski's Rule of Five, (s)-3-Amino-3-(4-nitrophenyl)propanoic acid has 2 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 (s)-3-Amino-3-(4-nitrophenyl)propanoic acid?
The CAS number of (s)-3-Amino-3-(4-nitrophenyl)propanoic acid is 501030-96-2.
What is the molecular formula of (s)-3-Amino-3-(4-nitrophenyl)propanoic acid?
The molecular formula of (s)-3-Amino-3-(4-nitrophenyl)propanoic acid is C9H10N2O4.
What is the molecular weight of (s)-3-Amino-3-(4-nitrophenyl)propanoic acid?
The molecular weight of (s)-3-Amino-3-(4-nitrophenyl)propanoic acid is 210.06 g/mol.
Where can I buy (s)-3-Amino-3-(4-nitrophenyl)propanoic acid?
You can request a quote for (s)-3-Amino-3-(4-nitrophenyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (s)-3-Amino-3-(4-nitrophenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (s)-3-Amino-3-(4-nitrophenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.