AC1LXDTA
(4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
Also Known As: (S)-4,7-dimethyl-2-oxo-2H-chromen-5-yl 2-((tert-butoxycarbonyl)amino)-4-(methylthio)butanoate|(4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
CAS: 956044-40-9
| Molecular Formula | C21H27NO6S |
|---|---|
| Molecular Weight | 421.1559 g/mol |
| LogP | 3.96164 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.1559 |
| Monoisotopic Mass | 421.1559 |
| Heavy Atoms | 29 |
| Complexity | 960.02325 |
Chemical Identifiers
| CAS Number | 956044-40-9 |
|---|---|
| SMILES | CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OC(=O)[C@H](CCSC)NC(=O)OC(C)(C)C |
Product Overview
AC1LXDTA (CAS 956044-40-9), with molecular formula C21H27NO6S and molecular weight 421.1559 g/mol. IUPAC: (4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate.
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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