1,1-Dimethylethyl 4-[(4-nitrophenyl)methyl]-1-piperazinecarboxylate

CAS Registry Number®

130636-61-2
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CAS Name

1,1-Dimethylethyl 4-[(4-nitrophenyl)methyl]-1-piperazinecarboxylate

Molecular Formula

C16H23N3O4

Molecular Mass

321.37

Cite this Page

1,1-Dimethylethyl 4-[(4-nitrophenyl)methyl]-1-piperazinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=130636-61-2 (retrieved 2024-05-20) (CAS RN: 130636-61-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    99-100 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H23N3O4/c1-16(2,3)23-15(20)18-10-8-17(9-11-18)12-13-4-6-14(7-5-13)19(21)22/h4-7H,8-12H2,1-3H3

InChIKey

InChIKey=XWWBHMXIEAVTGS-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1CCN(CC2=CC=C(N(=O)=O)C=C2)CC1

Canonical SMILES

O=C(OC(C)(C)C)N1CCN(CC2=CC=C(C=C2)N(=O)=O)CC1

Other Names for this Substance

  • 1-Piperazinecarboxylic acid, 4-[(4-nitrophenyl)methyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[(4-nitrophenyl)methyl]-1-piperazinecarboxylate
  • 4-(4-Nitrobenzyl)piperazine-1-carboxylic acid tert-butyl ester
  • 1-Boc-4-(4-Nitrobenzyl)piperazine

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