1,1-Dimethylethyl 5-cyano-2,3-dihydro-1H-indole-1-carboxylate

CAS Registry Number®

874841-30-2
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CAS Name

1,1-Dimethylethyl 5-cyano-2,3-dihydro-1H-indole-1-carboxylate

Molecular Formula

C14H16N2O2

Molecular Mass

244.29

Cite this Page

1,1-Dimethylethyl 5-cyano-2,3-dihydro-1H-indole-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=874841-30-2 (retrieved 2024-09-13) (CAS RN: 874841-30-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    162-165 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H16N2O2/c1-14(2,3)18-13(17)16-7-6-11-8-10(9-15)4-5-12(11)16/h4-5,8H,6-7H2,1-3H3

InChIKey

InChIKey=KDJNHMDZHOBDOJ-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C=2C(CC1)=CC(C#N)=CC2

Canonical SMILES

N#CC1=CC=C2C(=C1)CCN2C(=O)OC(C)(C)C

Other Names for this Substance

  • 1H-Indole-1-carboxylic acid, 5-cyano-2,3-dihydro-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 5-cyano-2,3-dihydro-1H-indole-1-carboxylate