1,1-Dimethylethyl 5-fluoro-3-iodo-1H-indole-1-carboxylate

CAS Registry Number®

192189-13-2
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CAS Name

1,1-Dimethylethyl 5-fluoro-3-iodo-1H-indole-1-carboxylate

Molecular Formula

C13H13FINO2

Molecular Mass

361.15

Cite this Page

1,1-Dimethylethyl 5-fluoro-3-iodo-1H-indole-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=192189-13-2 (retrieved 2024-09-06) (CAS RN: 192189-13-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    76 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H13FINO2/c1-13(2,3)18-12(17)16-7-10(15)9-6-8(14)4-5-11(9)16/h4-7H,1-3H3

InChIKey

InChIKey=DGGDRRGYXBFEIU-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C=2C(C(I)=C1)=CC(F)=CC2

Canonical SMILES

O=C(OC(C)(C)C)N1C=C(I)C=2C=C(F)C=CC21

Other Names for this Substance

  • 1H-Indole-1-carboxylic acid, 5-fluoro-3-iodo-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 5-fluoro-3-iodo-1H-indole-1-carboxylate
  • N-Boc-5-fluoro-3-iodoindole
  • tert-Butyl 5-fluoro-3-iodo-1H-indole-1-carboxylate