Hexamethylene diisothiocyanate

CAS Registry Number®

5586-70-9

CAS Name

Hexamethylene diisothiocyanate

Molecular Formula

C8H12N2S2

Molecular Mass

200.32

Cite this Page

Hexamethylene diisothiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5586-70-9 (retrieved 2024-11-22) (CAS RN: 5586-70-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    183-184 °C @ Press: 6 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H12N2S2/c11-7-9-5-3-1-2-4-6-10-8-12/h1-6H2

InChIKey

InChIKey=VZZPYUKWXDLMGI-UHFFFAOYSA-N

SMILES

C(CCCN=C=S)CCN=C=S

Canonical SMILES

S=C=NCCCCCCN=C=S

Other Names for this Substance

  • Hexane, 1,6-diisothiocyanato-
  • Isothiocyanic acid, hexamethylene ester
  • 1,6-Diisothiocyanatohexane
  • Hexamethylene diisothiocyanate
  • 1,6-Hexanediisothiocyanate

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