Methyl 4-(4-hydroxy-1-butyn-1-yl)-α,α-di(methyl-d3)benzeneacetate

CAS Registry Number®

1020719-49-6

CAS Name

Methyl 4-(4-hydroxy-1-butyn-1-yl)-α,α-di(methyl-d3)benzeneacetate

Molecular Formula

C15H12D6O3

Cite this Page

Methyl 4-(4-hydroxy-1-butyn-1-yl)-α,α-di(methyl-d3)benzeneacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1020719-49-6 (retrieved 2024-11-23) (CAS RN: 1020719-49-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H18O3/c1-15(2,14(17)18-3)13-9-7-12(8-10-13)6-4-5-11-16/h7-10,16H,5,11H2,1-3H3/i1D3,2D3

InChIKey

InChIKey=QZGRXTVHAIGNKD-WFGJKAKNSA-N

SMILES

C(C(OC)=O)(C([2H])([2H])[2H])(C([2H])([2H])[2H])C1=CC=C(C#CCCO)C=C1

Canonical SMILES

O=C(OC)C(C1=CC=C(C#CCCO)C=C1)(C)C

Other Names for this Substance

  • Benzeneacetic acid, 4-(4-hydroxy-1-butyn-1-yl)-α,α-di(methyl-d3)-, methyl ester
  • Methyl 4-(4-hydroxy-1-butyn-1-yl)-α,α-di(methyl-d3)benzeneacetate

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