1-[3,5-Bis(1,1-dimethylethyl)phenyl]-1-propanone

CAS Registry Number®

17610-02-5
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CAS Name

1-[3,5-Bis(1,1-dimethylethyl)phenyl]-1-propanone

Molecular Formula

C17H26O

Molecular Mass

246.39

Cite this Page

1-[3,5-Bis(1,1-dimethylethyl)phenyl]-1-propanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17610-02-5 (retrieved 2024-08-29) (CAS RN: 17610-02-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    133 °C @ Press: 3 Torr

  • Melting Point (2)

    133-135 °C

  • Density (1)

    0.9239 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H26O/c1-8-15(18)12-9-13(16(2,3)4)11-14(10-12)17(5,6)7/h9-11H,8H2,1-7H3

InChIKey

InChIKey=NXHMPVRUKKYVHR-UHFFFAOYSA-N

SMILES

C(C)(C)(C)C1=CC(C(C)(C)C)=CC(C(CC)=O)=C1

Canonical SMILES

O=C(C=1C=C(C=C(C1)C(C)(C)C)C(C)(C)C)CC

Other Names for this Substance

  • 1-Propanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]-
  • Propiophenone, 3′,5′-di-tert-butyl-
  • 1-[3,5-Bis(1,1-dimethylethyl)phenyl]-1-propanone
  • 1-(3,5-Di-tert-butyl-phenyl)-propan-1-one