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4-(3,5-Dioxo-4-thiomorpholinyl)benzonitrile

HCID 1474065
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
338409-78-2
Standard SMILES
N#Cc1ccc(N2C(=O)CSCC2=O)cc1
InChIKey
QDGLXYFFLSYQOW-UHFFFAOYSA-N
Molecular formula
C11H8N2O2S
Average molar mass
232.264 g/mol
Monoisotopic mass
232.0306485

Names & identifiers

Preferred name
4-(3,5-Dioxo-4-thiomorpholinyl)benzonitrile
IUPAC
4-(3,5-Dioxothiomorpholin-4-yl)benzonitrile
English name
4-(3,5-DIOXO-1,4-THIAZINAN-4-YL)BENZENECARBONITRILE
Molecular formula
C11H8N2O2S
Molecular weight
232.26

Names & synonyms

4-(3,5-Dioxothiomorpholino)benzonitrile4-(3,5-dioxothiomorpholin-4-yl)benzonitrileBenzonitrile, 4-(3,5-dioxo-4-thiomorpholinyl)-4-(3,5-DIOXO-1,4-THIAZINAN-4-YL)BENZENECARBONITRILE

Database identifiers

CAS
338409-78-2
PubChem CID
1474065
DTXSID
DTXSID401263726

Properties

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

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Compound notes

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