AC1MF5CC
ditert-butyl 4-hydroxy-4-methyl-2-(3-nitrophenyl)-6-oxocyclohexane-1,3-dicarboxylate
Also Known As: CBMicro_033059|AT-057/13384634|di-tert-butyl 4-hydroxy-4-methyl-2-(3-nitrophenyl)-6-oxocyclohexane-1,3-dicarboxylate|ditert-butyl 4-hydroxy-4-methyl-2-(3-nitrophenyl)-6-oxocyclohexane-1,3-dicarboxylate|di(tert-butyl) 4-hydroxy-4-methyl-2-(3-nitrophenyl)-6-oxo-1,3-cyclohexanedicarboxylate|1,3-DI-TERT-BUTYL 4-HYDROXY-4-METHYL-2-(3-NITROPHENYL)-6-OXOCYCLOHEXANE-1,3-DICARBOXYLATE
| Molecular Formula | C23H31NO8 |
|---|---|
| Molecular Weight | 449.20496 g/mol |
| LogP | 3.318 |
| Topological Polar Surface Area | 133.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.20496 |
| Monoisotopic Mass | 449.20496 |
| Heavy Atoms | 32 |
| Complexity | 922.6595 |
Chemical Identifiers
| CAS Number | 459147-65-0 |
|---|---|
| SMILES | CC1(CC(=O)C(C(C1C(=O)OC(C)(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)(C)C)O |
Product Overview
AC1MF5CC (CAS 459147-65-0), with molecular formula C23H31NO8 and molecular weight 449.20496 g/mol. IUPAC: ditert-butyl 4-hydroxy-4-methyl-2-(3-nitrophenyl)-6-oxocyclohexane-1,3-dicarboxylate.
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