tert-Butylbenzene

CAS Registry Number®

98-06-6

CAS Name

tert-Butylbenzene

Molecular Formula

C10H14

Molecular Mass

134.22

Cite this Page

tert-Butylbenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=98-06-6 (retrieved 2024-11-24) (CAS RN: 98-06-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    169.1 °C

  • Melting Point (1)

    -57.8 °C

  • Density (1)

    0.8669 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/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3

InChIKey

InChIKey=YTZKOQUCBOVLHL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

C=1C=CC(=CC1)C(C)(C)C

Other Names for this Substance

  • Benzene, (1,1-dimethylethyl)-
  • Benzene, tert-butyl-
  • (1,1-Dimethylethyl)benzene
  • tert-Butylbenzene
  • 2-Methyl-2-phenylpropane

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