Methyl 2,5-bis(1,1-dimethylethyl)-γ-oxo-3-thiophenebutanoate

CAS Registry Number®

33492-34-1
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CAS Name

Methyl 2,5-bis(1,1-dimethylethyl)-γ-oxo-3-thiophenebutanoate

Molecular Formula

C17H26O3S

Molecular Mass

310.45

Cite this Page

Methyl 2,5-bis(1,1-dimethylethyl)-γ-oxo-3-thiophenebutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=33492-34-1 (retrieved 2024-08-22) (CAS RN: 33492-34-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H26O3S/c1-16(2,3)13-10-11(15(21-13)17(4,5)6)12(18)8-9-14(19)20-7/h10H,8-9H2,1-7H3

InChIKey

InChIKey=FXXNYMXQPLYZMZ-UHFFFAOYSA-N

SMILES

C(CCC(OC)=O)(=O)C1=C(C(C)(C)C)SC(C(C)(C)C)=C1

Canonical SMILES

O=C(OC)CCC(=O)C=1C=C(SC1C(C)(C)C)C(C)(C)C

Other Names for this Substance

  • 3-Thiophenebutanoic acid, 2,5-bis(1,1-dimethylethyl)-γ-oxo-, methyl ester
  • 3-Thiophenebutyric acid, 2,5-di-tert-butyl-γ-oxo-, methyl ester
  • Methyl 2,5-bis(1,1-dimethylethyl)-γ-oxo-3-thiophenebutanoate