1,1-Dimethylethyl 3-iodo-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

CAS Registry Number®

1228183-72-9
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CAS Name

1,1-Dimethylethyl 3-iodo-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

Molecular Formula

C13H12F3IN2O2

Molecular Mass

412.15

Cite this Page

1,1-Dimethylethyl 3-iodo-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1228183-72-9 (retrieved 2024-05-06) (CAS RN: 1228183-72-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12F3IN2O2/c1-12(2,3)21-11(20)19-6-9(17)8-4-7(13(14,15)16)5-18-10(8)19/h4-6H,1-3H3

InChIKey

InChIKey=CTOFYYMHNAVHTR-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C=2C(=CC(C(F)(F)F)=CN2)C(I)=C1

Canonical SMILES

O=C(OC(C)(C)C)N1C=C(I)C=2C=C(C=NC21)C(F)(F)F

Other Names for this Substance

  • 1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-iodo-5-(trifluoromethyl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 3-iodo-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

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