Methyl 4-((4-nitrophenyl)amino)but-2-ynoate
methyl 4-(4-nitroanilino)but-2-ynoate
Also Known As: methyl 4-(4-nitroanilino)but-2-ynoate|methyl 4-((4-nitrophenyl)amino)but-2-ynoate|methyl 4-[(4-nitrophenyl)amino]but-2-ynoate
CAS: 313684-47-8
| Molecular Formula | C11H10N2O4 |
|---|---|
| Molecular Weight | 234.06406 g/mol |
| LogP | 1.1831 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.06406 |
| Monoisotopic Mass | 234.06406 |
| Heavy Atoms | 17 |
| Complexity | 470.48508 |
Chemical Identifiers
| CAS Number | 313684-47-8 |
|---|---|
| SMILES | COC(=O)C#CCNC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
Methyl 4-((4-nitrophenyl)amino)but-2-ynoate (CAS 313684-47-8), with molecular formula C11H10N2O4 and molecular weight 234.06406 g/mol. IUPAC: methyl 4-(4-nitroanilino)but-2-ynoate.
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.
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