(Q27257059)

2-(Methyldithio)isobutyraldehyde (English)

14 October 2016

chemical formula

C₅H₁₀OS₂

1 reference

2-(Methyldithio)isobutyraldehyde (English)

14 October 2016

canonical SMILES

CC(C)(C=O)SSC

1 reference

2-(Methyldithio)isobutyraldehyde (English)

InChI=1S/C5H10OS2/c1-5(2,4-6)8-7-3/h4H,1-3H3

14 October 2016

Identifiers

InChI

1 reference

2-(Methyldithio)isobutyraldehyde (English)

14 October 2016

1 reference

Global Substance Registration System

2-(Methyldithio)isobutyraldehyde (English)

14 October 2016

2 references

2-(methyldithio)isobutyraldehyde (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=67952-60-7

10 April 2021

1 reference

2-(Methyldithio)isobutyraldehyde (English)

14 October 2016

2 references

2-(Methyldithio)isobutyraldehyde (English)

14 October 2016

ChEBI ID

173635

mapping relation type

exact match

2 references

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C5H10OS2/c1-5(2,4-6)8-7-3/h4H,1-3H3

1 reference

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

DTXCID5045332

0 references

EC number

267-914-1

1 reference

Global Substance Registration System

2-(methyldithio)isobutyraldehyde (English)

ECHA Substance Infocard ID

14 October 2016

100.061.722

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.061.722

27 December 2018

Human Metabolome Database ID

2-methyl-2-(methyldithio)propionaldehyde (English)

quotation

CAS no.: 67952-60-7 (English)

FL number

12.168

1 reference

quotation

CAS no.: 67952-60-7 (English)

23 January 2021

12.168

HMDB0038889

2 references

based on heuristic

inferred from InChIKey

2 references

Global Substance Registration System

2-(methyldithio)isobutyraldehyde (English)

14 October 2016

JECFA number

580

1 reference

Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)