(Q27160237)

1-Hydroxybutan-2-one (English)

9 October 2016

chemical formula

C₄H₈O₂

1 reference

1-Hydroxybutan-2-one (English)

20 November 2016

canonical SMILES

CCC(=O)CO

1 reference

Volatile flavor components of licorice

1-Hydroxybutan-2-one (English)

20 November 2016

1 reference

Identifiers

InChI

InChI=1S/C4H8O2/c1-2-4(6)3-5/h5H,2-3H2,1H3

1 reference

1-Hydroxybutan-2-one (English)

20 November 2016

2 references

1-Hydroxybutan-2-one (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

5077-67-8

2 references

Global Substance Registration System

1-hydroxy-2-butanone (English)

20 November 2016

https://commonchemistry.cas.org/detail?cas_rn=5077-67-8

9 April 2021

1 reference

2-Oxobutanol (English)

20 November 2016

2 references

1-Hydroxybutan-2-one (English)

20 November 2016

ChEBI ID

88390

mapping relation type

2 references

1-Hydroxy-2-butanone (English)

9 October 2016

International Chemical Identifier

InChI

InChI=1S/C4H8O2/c1-2-4(6)3-5/h5H,2-3H2,1H3

1 reference

2 references

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

DSSTOX compound identifier

DTXCID6040905

0 references

EC number

225-790-6

1 reference

Global Substance Registration System

1-hydroxy-2-butanone (English)

ECHA Substance Infocard ID

20 November 2016

100.023.446

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.023.446

27 December 2018

AICS Chemical ID (BEING DELETED)

1-hydroxybutan-2-one (English)

quotation

CAS no.: 5077-67-8 (English)

8958

0 references

Human Metabolome Database ID

HMDB0031507

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00052574

2 references

based on heuristic

inferred from InChIKey

2 references

Global Substance Registration System

1-hydroxy-2-butanone (English)

20 November 2016