(S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride
TL;DR: (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride (CAS 331846-95-8) is a chemical compound with molecular formula C11H16ClNO2 and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-4-(4-methylphenyl)butanoic acid;hydrochloride
Also Known As: (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride, H-Phe(4-Me)-OH HCl, 4-Methyl-L-beta-homophenylalanine hydrochloride, H-beta-HPhe(4-Me)-OH HCl, H-
| Molecular Formula | C11H16ClNO2 |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 1.76132 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.08696 |
| Heavy Atoms | 15 |
| Complexity | 310.8689 |
Chemical Identifiers
| CAS Number | 331846-95-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C[C@@H](CC(=O)O)N.Cl |
Product Overview
(S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride (CAS 331846-95-8), with molecular formula C11H16ClNO2 and molecular weight 229.09 g/mol. IUPAC: (3S)-3-amino-4-(4-methylphenyl)butanoic acid;hydrochloride.
Chemical Property Profile of (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride
Property Insights of (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride
The XLogP value of 1.76132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride. Following Lipinski's Rule of Five, (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride has 2 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 (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride?
The CAS number of (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride is 331846-95-8.
What is the molecular formula of (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride?
The molecular formula of (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride is C11H16ClNO2.
What is the molecular weight of (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride?
The molecular weight of (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride is 229.09 g/mol.
Where can I buy (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride?
You can request a quote for (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride 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-4-(p-tolyl)butanoic acid hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-Amino-4-(p-tolyl)butanoic acid hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.