![N-[3,4-Dichlorophenyl]-beta-alanine structure](/static/products/3139/31399-32-3.webp)
N-[3,4-Dichlorophenyl]-beta-alanine
3-(3,4-dichloroanilino)propanoic acid
Also Known As: N-[3,4-Dichlorophenyl]-beta-alanine|3-(3,4-Dichloroanilino)propanoic acid|3-[(3,4-dichlorophenyl)amino]propanoic acid|N-[3,4-Dichlorophenyl]-.beta.-alanine|3-(3,4-Dichloroanilino)propanoic acid #
CAS: 31399-32-3
| Molecular Formula | C9H9Cl2NO2 |
|---|---|
| Molecular Weight | 233.00104 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.00104 |
| Monoisotopic Mass | 233.00104 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 31399-32-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1NCCC(=O)O)Cl)Cl |
| InChIKey | DMALXOMZQXHECQ-UHFFFAOYSA-N |
Product Overview
N-[3,4-Dichlorophenyl]-beta-alanine (CAS 31399-32-3), with molecular formula C9H9Cl2NO2 and molecular weight 233.00104 g/mol. IUPAC: 3-(3,4-dichloroanilino)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 →
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