Erucin

CAS Registry Number®

4430-36-8

CAS Name

Erucin

Molecular Formula

C6H11NS2

Molecular Mass

161.29

Cite this Page

Erucin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4430-36-8 (retrieved 2024-11-22) (CAS RN: 4430-36-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    130-140 °C @ Press: 9 Torr

  • Melting Point (2)

    50 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H11NS2/c1-9-5-3-2-4-7-6-8/h2-5H2,1H3

InChIKey

InChIKey=IHQDGXUYTSZGOG-UHFFFAOYSA-N

SMILES

C(CCSC)CN=C=S

Canonical SMILES

S=C=NCCCCSC

Other Names for this Substance

  • Butane, 1-isothiocyanato-4-(methylthio)-
  • Isothiocyanic acid, 4-(methylthio)butyl ester
  • 1-Isothiocyanato-4-(methylthio)butane
  • 4-(Methylthio)butyl isothiocyanate
  • Erucin

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration