1,1-Dimethylethyl 3-(aminothioxomethyl)-1-pyrrolidinecarboxylate

CAS Registry Number®

122684-35-9

CAS Name

1,1-Dimethylethyl 3-(aminothioxomethyl)-1-pyrrolidinecarboxylate

Molecular Formula

C10H18N2O2S

Molecular Mass

230.33

Cite this Page

1,1-Dimethylethyl 3-(aminothioxomethyl)-1-pyrrolidinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=122684-35-9 (retrieved 2024-12-19) (CAS RN: 122684-35-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    131-133 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C10H18N2O2S/c1-10(2,3)14-9(13)12-5-4-7(6-12)8(11)15/h7H,4-6H2,1-3H3,(H2,11,15)

InChIKey

InChIKey=FKLPAGOTHFVRLL-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1CC(C(N)=S)CC1

Canonical SMILES

O=C(OC(C)(C)C)N1CCC(C(=S)N)C1

Other Names for this Substance

  • 1-Pyrrolidinecarboxylic acid, 3-(aminothioxomethyl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 3-(aminothioxomethyl)-1-pyrrolidinecarboxylate
  • 3-Thiocarbamoylpyrrolidine-1-carboxylic acid tert-butyl ester
  • tert-Butyl 3-carbamothioylpyrrolidine-1-carboxylate
  • 1-Boc-3-thiocarbamoyl-pyrrolidine

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