3-[[(2R)-2,3-Dihydro-2-(hydroxymethyl)-1H-inden-4-yl]oxy]phenyl 4,4,4-trifluoro-1-butanesulfonate

CAS Registry Number®

212188-60-8
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CAS Name

3-[[(2R)-2,3-Dihydro-2-(hydroxymethyl)-1H-inden-4-yl]oxy]phenyl 4,4,4-trifluoro-1-butanesulfonate

Molecular Formula

C20H21F3O5S

Molecular Mass

430.44

Cite this Page

3-[[(2R)-2,3-Dihydro-2-(hydroxymethyl)-1H-inden-4-yl]oxy]phenyl 4,4,4-trifluoro-1-butanesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=212188-60-8 (retrieved 2024-05-18) (CAS RN: 212188-60-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H21F3O5S/c21-20(22,23)8-3-9-29(25,26)28-17-6-2-5-16(12-17)27-19-7-1-4-15-10-14(13-24)11-18(15)19/h1-2,4-7,12,14,24H,3,8-11,13H2/t14-/m1/s1

InChIKey

InChIKey=XJURALZPEJKKOV-CQSZACIVSA-N

SMILES

O(C1=C2C(C[C@@H](CO)C2)=CC=C1)C3=CC(OS(CCCC(F)(F)F)(=O)=O)=CC=C3

Canonical SMILES

O=S(=O)(OC=1C=CC=C(OC2=CC=CC3=C2CC(CO)C3)C1)CCCC(F)(F)F

Other Names for this Substance

  • 1-Butanesulfonic acid, 4,4,4-trifluoro-, 3-[[(2R)-2,3-dihydro-2-(hydroxymethyl)-1H-inden-4-yl]oxy]phenyl ester
  • 3-[[(2R)-2,3-Dihydro-2-(hydroxymethyl)-1H-inden-4-yl]oxy]phenyl 4,4,4-trifluoro-1-butanesulfonate
  • BAY 38-7271

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