3-(4-Chloro-2-nitroanilino)propanoic acid
3-(4-chloro-2-nitroanilino)propanoic acid
Also Known As: 3-(4-chloro-2-nitroanilino)propanoic acid|3-(4-chloro-2-nitroanilino)-propionic acid|B-alanine,n-(4-chloro-2-nitrophenyl)-|N-(4-chloro-2-nitrophenyl)-beta-alanine|3-(4-chloro-2-nitrophenylamino)propionic acid|3-[(4-chloro-2-nitrophenyl)amino]propanoic acid
CAS: 2963-45-3
| Molecular Formula | C9H9ClN2O4 |
|---|---|
| Molecular Weight | 244.02509 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.02509 |
| Monoisotopic Mass | 244.02509 |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 2963-45-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)[N+](=O)[O-])NCCC(=O)O |
| InChIKey | CUJKGDAPMSUCRL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (3 patents)
Pharmaceutical Intermediates (3 patents)
Product Overview
3-(4-Chloro-2-nitroanilino)propanoic acid (CAS 2963-45-3), with molecular formula C9H9ClN2O4 and molecular weight 244.02509 g/mol. IUPAC: 3-(4-chloro-2-nitroanilino)propanoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
3-(4-Chloro-2-nitroanilino)propanoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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