N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine
TL;DR: N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine (CAS 102-66-9) is a chemical compound with molecular formula C10H11N3O5 and molecular weight 253.06987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-nitrophenyl)carbamoylamino]propanoic acid
Also Known As: Suosan, Aspartic acid-beta-4-nitroanilide, Aspartic acid-beta-p-nitroanilide, 3-[(4-nitrophenyl)carbamoylamino]propanoic acid, N-(4-Nitrophenyl)-N'-(carboxyethyl)urea
Technical Specifications
| Molecular Formula | C10H11N3O5 |
| Molecular Weight | 253.06987 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.06987 Da |
| Heavy Atoms | 18 |
| Complexity | 320.0 |
| SMILES | C1=CC(=CC=C1NC(=O)NCCC(=O)O)[N+](=O)[O-] |
| InChIKey | MYMZLBHZVRWYRE-UHFFFAOYSA-N |
Product Description
Applications: N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine (CAS 102-66-9) has the molecular formula C10H11N3O5 and a molecular weight of 253.07 g/mol. Synonyms include Suosan and Aspartic acid-beta-4-nitroanilide.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine
Property Insights of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine. Following Lipinski's Rule of Five, N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine?
The CAS number of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine is 102-66-9.
What is the molecular formula of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine?
The molecular formula of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine is C10H11N3O5.
What is the molecular weight of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine?
The molecular weight of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine is 253.06987 g/mol.
What are the applications of N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine?
N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine?
You can request a quote for N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine?
Yes, CoreyChem provides custom synthesis services for N-(((4-Nitrophenyl)amino)carbonyl)-beta-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.