2-(Trifluoroacetyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonyl chloride

CAS Registry Number®

74291-57-9

CAS Name

2-(Trifluoroacetyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonyl chloride

Molecular Formula

C11H9ClF3NO3S

Molecular Mass

327.71

Cite this Page

2-(Trifluoroacetyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonyl chloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=74291-57-9 (retrieved 2024-11-21) (CAS RN: 74291-57-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    108-109 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C11H9ClF3NO3S/c12-20(18,19)9-2-1-7-3-4-16(6-8(7)5-9)10(17)11(13,14)15/h1-2,5H,3-4,6H2

InChIKey

InChIKey=SXIYEBVAQTUBOQ-UHFFFAOYSA-N

SMILES

C(C(F)(F)F)(=O)N1CC=2C(=CC=C(S(Cl)(=O)=O)C2)CC1

Canonical SMILES

O=C(N1CC2=CC(=CC=C2CC1)S(=O)(=O)Cl)C(F)(F)F

Other Names for this Substance

  • 7-Isoquinolinesulfonyl chloride, 1,2,3,4-tetrahydro-2-(2,2,2-trifluoroacetyl)-
  • 7-Isoquinolinesulfonyl chloride, 1,2,3,4-tetrahydro-2-(trifluoroacetyl)-
  • 1,2,3,4-Tetrahydro-2-(2,2,2-trifluoroacetyl)-7-isoquinolinesulfonyl chloride
  • N-Trifluoroacetyl-1,2,3,4-tetrahydroisoquinoline-7-sulfonyl chloride
  • 1,2,3,4-Tetrahydro-2-(trifluoroacetyl)isoquinoline-7-sulfonyl chloride

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Deleted or Replaced CAS Registry Numbers

606969-20-4