(S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid
TL;DR: (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid (CAS 1269931-37-4) is a chemical compound with molecular formula C10H12ClNO3 and molecular weight 229.05057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-amino-3-(3-chloro-4-methoxyphenyl)propanoic acid
Also Known As: BAS 10156020, (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid, (3S)-3-amino-3-(3-chloro-4-methoxyphenyl)propanoic acid
Technical Specifications
| Molecular Formula | C10H12ClNO3 |
| Molecular Weight | 229.05057 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.05057 Da |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
| SMILES | COC1=C(C=C(C=C1)[C@H](CC(=O)O)N)Cl |
| InChIKey | JTMCTXSKEUTZNI-QMMMGPOBSA-N |
Chemical Property Profile of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid
Property Insights of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid
The XLogP value of -0.7 indicates that (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid. Following Lipinski's Rule of Five, (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid?
The CAS number of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid is 1269931-37-4.
What is the molecular formula of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid?
The molecular formula of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid is C10H12ClNO3.
What is the molecular weight of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid?
The molecular weight of (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid is 229.05057 g/mol.
Where can I buy (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid?
You can request a quote for (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid?
Yes, CoreyChem provides custom synthesis services for (S)-3-Amino-3-(3-chloro-4-methoxyphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.