N-(3,4-dichlorophenyl)alanine
TL;DR: N-(3,4-dichlorophenyl)alanine (CAS 33878-51-2) is a chemical compound with molecular formula C9H9Cl2NO2 and molecular weight 233.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(3,4-dichloroanilino)propanoic acid
Also Known As: N-(3,4-dichlorophenyl)alanine, N-(3,4dichlorophenyl)alanine, n-(3,4-dichlorophenyl)-l-alanine, L-Alanine, N-(3,4-dichlorophenyl)-, L-, (2S)-2-(3,4-dichloroanilino)propanoic acid
| Molecular Formula | C9H9Cl2NO2 |
|---|---|
| Molecular Weight | 233.00 g/mol |
| LogP | 2.8784 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.00104 |
| Heavy Atoms | 14 |
| Complexity | 354.66522 |
Chemical Identifiers
| CAS Number | 33878-51-2 |
|---|---|
| SMILES | C[C@@H](C(=O)O)NC1=CC(=C(C=C1)Cl)Cl |
Product Overview
N-(3,4-dichlorophenyl)alanine (CAS 33878-51-2), with molecular formula C9H9Cl2NO2 and molecular weight 233.00 g/mol. IUPAC: (2S)-2-(3,4-dichloroanilino)propanoic acid.
Chemical Property Profile of N-(3,4-dichlorophenyl)alanine
Property Insights of N-(3,4-dichlorophenyl)alanine
The XLogP value of 2.8784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dichlorophenyl)alanine. With a topological polar surface area (TPSA) of 49.33 Ų, N-(3,4-dichlorophenyl)alanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dichlorophenyl)alanine 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 N-(3,4-dichlorophenyl)alanine?
The CAS number of N-(3,4-dichlorophenyl)alanine is 33878-51-2.
What is the molecular formula of N-(3,4-dichlorophenyl)alanine?
The molecular formula of N-(3,4-dichlorophenyl)alanine is C9H9Cl2NO2.
What is the molecular weight of N-(3,4-dichlorophenyl)alanine?
The molecular weight of N-(3,4-dichlorophenyl)alanine is 233.00 g/mol.
Where can I buy N-(3,4-dichlorophenyl)alanine?
You can request a quote for N-(3,4-dichlorophenyl)alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dichlorophenyl)alanine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dichlorophenyl)alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.