1-Isothiocyanato-6-(methylthio)hexane

CAS Registry Number®

4430-39-1

CAS Name

1-Isothiocyanato-6-(methylthio)hexane

Molecular Formula

C8H15NS2

Molecular Mass

189.34

Cite this Page

1-Isothiocyanato-6-(methylthio)hexane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4430-39-1 (retrieved 2024-11-22) (CAS RN: 4430-39-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    119 °C @ Press: 0.5 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H15NS2/c1-11-7-5-3-2-4-6-9-8-10/h2-7H2,1H3

InChIKey

InChIKey=YIBXPFAXPUDDTK-UHFFFAOYSA-N

SMILES

C(CCCSC)CCN=C=S

Canonical SMILES

S=C=NCCCCCCSC

Other Names for this Substance

  • Hexane, 1-isothiocyanato-6-(methylthio)-
  • Isothiocyanic acid, 6-(methylthio)hexyl ester
  • 1-Isothiocyanato-6-(methylthio)hexane
  • 6-Methylthiohexyl isothiocyanate
  • Lesquerellin

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration