1-Isothiocyanato-8-(methylthio)octane

CAS Registry Number®

4430-41-5
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CAS Name

1-Isothiocyanato-8-(methylthio)octane

Molecular Formula

C10H19NS2

Molecular Mass

217.39

Cite this Page

1-Isothiocyanato-8-(methylthio)octane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4430-41-5 (retrieved 2024-08-30) (CAS RN: 4430-41-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    122 °C @ Press: 0.3 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H19NS2/c1-13-9-7-5-3-2-4-6-8-11-10-12/h2-9H2,1H3

InChIKey

InChIKey=BFBMDZOSZQDEKW-UHFFFAOYSA-N

SMILES

C(CCCCSC)CCCN=C=S

Canonical SMILES

S=C=NCCCCCCCCSC

Other Names for this Substance

  • Octane, 1-isothiocyanato-8-(methylthio)-
  • Isothiocyanic acid, 8-(methylthio)octyl ester
  • 1-Isothiocyanato-8-(methylthio)octane
  • 8-Methylthiooctyl isothiocyanate
  • Jirsutin

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