AC1NRO02
methyl 4-[[3-(2-bromo-5-methoxy-4-propoxyphenyl)-2-cyanoprop-2-enoyl]amino]benzoate
Also Known As: methyl 4-[[3-(2-bromo-5-methoxy-4-propoxyphenyl)-2-cyanoprop-2-enoyl]amino]benzoate|Methyl 4-[[3-(2-bromo-5-methoxy-4-propoxy-phenyl)-2-cyano-prop-2-enoyl]amino]benzoate|Methyl 4-[3-(2-bromo-5-methoxy-4-propoxyphenyl)-2-cyanoprop-2-enamido]benzoate
CAS: 5358-37-2
| Molecular Formula | C22H21BrN2O5 |
|---|---|
| Molecular Weight | 472.0634 g/mol |
| LogP | 4.57878 |
| Topological Polar Surface Area | 97.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 472.0634 |
| Monoisotopic Mass | 472.0634 |
| Heavy Atoms | 30 |
| Complexity | 993.8229 |
Chemical Identifiers
| CAS Number | 5358-37-2 |
|---|---|
| SMILES | CCCOC1=C(C=C(C(=C1)Br)C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)OC)OC |
Product Overview
AC1NRO02 (CAS 5358-37-2), with molecular formula C22H21BrN2O5 and molecular weight 472.0634 g/mol. IUPAC: methyl 4-[[3-(2-bromo-5-methoxy-4-propoxyphenyl)-2-cyanoprop-2-enoyl]amino]benzoate.
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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