(Q27282359)

5-BUTYL-1,4-DIOXAN-2-ONE (English)

14 October 2016

chemical formula

C₈H₁₄O₃

1 reference

5-BUTYL-1,4-DIOXAN-2-ONE (English)

14 October 2016

canonical SMILES

CCCCC1COC(=O)CO1

1 reference

5-BUTYL-1,4-DIOXAN-2-ONE (English)

InChI=1S/C8H14O3/c1-2-3-4-7-5-11-8(9)6-10-7/h7H,2-6H2,1H3

14 October 2016

Identifiers

InChI

1 reference

5-BUTYL-1,4-DIOXAN-2-ONE (English)

14 October 2016

1 reference

Global Substance Registration System

5-BUTYL-1,4-DIOXAN-2-ONE (English)

14 October 2016

1 reference

UNII

KP6ZV7PW9A

5-butyl-1,4-dioxan-2-one (English)

14 October 2016

1 reference

5-Butyl-1,4-dioxan-2-one (English)

14 October 2016

2 references

5-BUTYL-1,4-DIOXAN-2-ONE (English)

14 October 2016

ChEBI ID

173254

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C8H14O3/c1-2-3-4-7-5-11-8(9)6-10-7/h7H,2-6H2,1H3

1 reference

1 reference

DSSTOX compound identifier

DTXCID601323841

0 references

Human Metabolome Database ID

HMDB0059938

2 references

based on heuristic

inferred from InChIKey

Global Substance Registration System

UNII

KP6ZV7PW9A

2 references

stated in

UNII

KP6ZV7PW9A

5-butyl-1,4-dioxan-2-one (English)

14 October 2016