Sulforaphene

CAS Registry Number®

592-95-0

CAS Name

Sulforaphene

Molecular Formula

C6H9NOS2

Molecular Mass

175.27

Cite this Page

Sulforaphene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=592-95-0 (retrieved 2024-11-22) (CAS RN: 592-95-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    135 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H9NOS2/c1-10(8)5-3-2-4-7-6-9/h3,5H,2,4H2,1H3

InChIKey

InChIKey=QKGJFQMGPDVOQE-UHFFFAOYSA-N

SMILES

C(CCN=C=S)=CS(C)=O

Canonical SMILES

O=S(C=CCCN=C=S)C

Other Names for this Substance

  • 1-Butene, 4-isothiocyanato-1-(methylsulfinyl)-
  • Isothiocyanic acid, 4-(methylsulfinyl)-3-butenyl ester
  • Sulforaphen
  • 4-Isothiocyanato-1-(methylsulfinyl)-1-butene
  • Sulforaphene

View All

Deleted or Replaced CAS Registry Numbers

1393-06-2

CAS INSIGHTSTM
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