tert-Butyl acetate

CAS Registry Number®

540-88-5

CAS Name

tert-Butyl acetate

Molecular Formula

C6H12O2

Molecular Mass

116.16

Cite this Page

tert-Butyl acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=540-88-5 (retrieved 2024-11-21) (CAS RN: 540-88-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    97.8 °C

  • Melting Point (2)

    <25 °C

  • Density (1)

    0.8593 g/cm³ @ Temp: 25 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
  • (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C6H12O2/c1-5(7)8-6(2,3)4/h1-4H3

InChIKey

InChIKey=WMOVHXAZOJBABW-UHFFFAOYSA-N

SMILES

O(C(C)(C)C)C(C)=O

Canonical SMILES

O=C(OC(C)(C)C)C

Other Names for this Substance

  • Acetic acid, 1,1-dimethylethyl ester
  • Acetic acid, tert-butyl ester
  • tert-Butyl alcohol, acetate
  • tert-Butyl acetate
  • Texaco lead appreciator

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration