Pivaloylacetonitrile

CAS Registry Number®

59997-51-2

CAS Name

Pivaloylacetonitrile

Molecular Formula

C7H11NO

Molecular Mass

125.17

Cite this Page

Pivaloylacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59997-51-2 (retrieved 2024-11-21) (CAS RN: 59997-51-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    125-126 °C @ Press: 22 Torr

  • Melting Point (2)

    68 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H11NO/c1-7(2,3)6(9)4-5-8/h4H2,1-3H3

InChIKey

InChIKey=MXZMACXOMZKYHJ-UHFFFAOYSA-N

SMILES

C(C(C)(C)C)(CC#N)=O

Canonical SMILES

N#CCC(=O)C(C)(C)C

Other Names for this Substance

  • Pentanenitrile, 4,4-dimethyl-3-oxo-
  • Valeronitrile, 4,4-dimethyl-3-oxo-
  • 4,4-Dimethyl-3-oxopentanenitrile
  • Pivaloylacetonitrile
  • Pyvaolylacetonitrile

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration