3-Isothiocyanatooctane

CAS Registry Number®

519169-06-3

CAS Name

3-Isothiocyanatooctane

Molecular Formula

C9H17NS

Molecular Mass

171.30

Cite this Page

3-Isothiocyanatooctane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=519169-06-3 (retrieved 2024-12-19) (CAS RN: 519169-06-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H17NS/c1-3-5-6-7-9(4-2)10-8-11/h9H,3-7H2,1-2H3

InChIKey

InChIKey=IUOQCUQCXBFNRI-UHFFFAOYSA-N

SMILES

C(CCCCC)(N=C=S)CC

Canonical SMILES

S=C=NC(CC)CCCCC

Other Names for this Substance

  • Octane, 3-isothiocyanato-
  • 3-Isothiocyanatooctane

CAS INSIGHTSTM
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