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Catalog Number | ACM5950129 |
CAS Number | 5950-12-9 |
Structure | ![]() |
Synonyms | 5-Benzo[1,3]dioxol-5-yl-N-(2-methylpropyl)penta-2,4-dienamide |
Molecular Weight | 273.33 |
Molecular Formula | C16H19NO3 |
InChI | InChI=1S/C16H19NO3/c1-12(2)10-17-16(18)6-4-3-5-13-7-8-14-15(9-13)20-11-19-14/h3-9,12H,10-11H2,1-2H3,(H,17,18)/b5-3+,6-4+ |
InChI Key | WHAAPCGHVWVUEX-GGWOSOGESA-N |
Purity | 95%+ |
Complexity | 376 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 0 |
Exact Mass | 273.13649347 |
Heavy Atom Count | 20 |
Hydrogen Bond Acceptor Count | 3 |
Hydrogen Bond Donor Count | 1 |
Isomeric SMILES | CC(C)CNC(=O)/C=C/C=C/C1=CC2=C(C=C1)OCO2 |
Monoisotopic Mass | 273.13649347 |
PhysicalState | Powder |
Rotatable Bond Count | 5 |
Topological Polar Surface Area | 47.6 Ų |
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