4-tert-Butyltoluene

CAS Registry Number®

98-51-1

CAS Name

4-tert-Butyltoluene

Molecular Formula

C11H16

Molecular Mass

148.24

Cite this Page

4-tert-Butyltoluene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=98-51-1 (retrieved 2024-11-22) (CAS RN: 98-51-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    193 °C @ Press: 760 Torr

  • Melting Point (1)

    -52 °C

  • Density (1)

    0.8612 g/cm³ @ Temp: 20 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C11H16/c1-9-5-7-10(8-6-9)11(2,3)4/h5-8H,1-4H3

InChIKey

InChIKey=QCWXDVFBZVHKLV-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

C=1C=C(C=CC1C)C(C)(C)C

Other Names for this Substance

  • Benzene, 1-(1,1-dimethylethyl)-4-methyl-
  • Toluene, p-tert-butyl-
  • 1-(1,1-Dimethylethyl)-4-methylbenzene
  • p-tert-Butyltoluene
  • 1-tert-Butyl-4-methylbenzene

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