tert-Butyl 4-(3-methoxy-4-nitrophenyl)piperazine-1-carboxylate
Product Specifications
- CAS
- 1017782-79-4
- MF
- C16H23N3O5
- Appearance
- beige solid
- Synonym(s)
- 1-benzyl-4-(3-methoxy-4-nitrophenyl)piperazine; t-Butyl4-(3-methoxy-4-nitrophenyl)piperazine-1-carboxylate; 4-(3-Methoxy-4-nitrophenyl)piperazine-1-carboxylicacidtert-butylester; 1-Piperazinecarboxylicacid,4-(3-methoxy-4-nitrophenyl)-,1,1-dimethylethylester
- Shipping
- ambient temperature
- Storage
- 2-8°C
tert-Butyl 4-(3-methoxy-4-nitrophenyl)piperazine-1-carboxylate is identified by CAS 1017782-79-4 and molecular formula C16H23N3O5. PubChem resolves the number to one compound, CID 25918710, with molecular weight 337.37. The verified SMILES is CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])OC, and its InChIKey is ANJMFNJMNNJGRU-UHFFFAOYSA-N. PubChem lists 5-(4-BOC-piperazino)-2-nitroanisole as a synonym.
One piperazine nitrogen carries the tert-butoxycarbonyl group expressed by Boc in the older name. The opposite nitrogen attaches to a phenyl ring at its position 1. Relative to that connection, methoxy occupies position 3 and nitro position 4. The anisole-style synonym numbers the same ring from methoxy, placing nitro at 2 and piperazino at 5; the SMILES confirms that these are two naming orientations for one graph. The structure contains one neutral component and no stereochemical layer. Its five oxygens occur in the carbamate, methoxy, and charge-separated nitro group.
To frame an exact inquiry to Rlavie, provide CAS 1017782-79-4, the expanded piperazine carboxylate name, and the requested quantity. Add a MOL or SDF structure file so the protected nitrogen and the 3-methoxy-4-nitrophenyl pattern can be checked against PubChem CID 25918710, the SMILES, and InChIKey ANJMFNJMNNJGRU-UHFFFAOYSA-N. The identity comparison should precede request-specific information. Retaining both substituent positions prevents the abbreviated nitroanisole synonym from being confused with another methoxy, nitro, or piperazine arrangement.