2-ethylbutyl acetate (Q20054518)

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chemical compound

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Language	Label	Description	Also known as
English	2-ethylbutyl acetate	chemical compound

Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

chemical structure

2-Ethylbutylacetat.svg
356 × 190; 8 KB

1 reference

imported from Wikimedia project

German Wikipedia

mass

144.115±0 dalton

1 reference

stated in

PubChem

PubChem CID

61448

language of work or name

English

title

2-Ethylbutyl acetate (English)

retrieved

14 October 2016

chemical formula

C₈H₁₆O₂

1 reference

stated in

PubChem

PubChem CID

61448

language of work or name

English

title

2-Ethylbutyl acetate (English)

retrieved

14 October 2016

canonical SMILES

CCC(CC)COC(=O)C

1 reference

stated in

PubChem

PubChem CID

61448

language of work or name

English

title

2-Ethylbutyl acetate (English)

retrieved

14 October 2016

Identifiers

InChI

InChI=1S/C8H16O2/c1-4-8(5-2)6-10-7(3)9/h8H,4-6H2,1-3H3

1 reference

stated in

PubChem

PubChem CID

61448

language of work or name

English

title

2-Ethylbutyl acetate (English)

retrieved

14 October 2016

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

1 reference

stated in

PubChem

PubChem CID

61448

language of work or name

English

title

2-Ethylbutyl acetate (English)

retrieved

14 October 2016

CAS Registry Number

10031-87-5

2 references

stated in

Global Substance Registration System

UNII

R7S9T22253

language of work or name

English

title

2-ethylbutyl acetate (English)

retrieved

14 October 2016

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

8 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=10031-87-5

ChemSpider ID

55372

1 reference

stated in

ChemSpider

ChemSpider ID

55372

language of work or name

English

title

2-Ethylbutyl acetate (English)

retrieved

14 October 2016

PubChem CID

61448

2 references

stated in

PubChem

PubChem CID

61448

language of work or name

English

title

2-Ethylbutyl acetate (English)

retrieved

14 October 2016

matched by identifier from

InChIKey

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

ChEBI ID

179948

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C8H16O2/c1-4-8(5-2)6-10-7(3)9/h8H,4-6H2,1-3H3

SureChEMBL ID

SCHEMBL27305

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

UniChem compound ID

5986749

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP006810

0 references

SPLASH

splash10-0006-9000000000-bca3da23b67bd36d65b4

0 references

NMRShiftDB structure ID

20200733

1 reference

matched by identifier from

InChIKey

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

CAMEO Chemicals ID

670

0 references

ZVG number

490510

0 references

DSSTox substance ID

DTXSID5064916

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID6032516

0 references

EC number

233-095-4

1 reference

stated in

Global Substance Registration System

UNII

R7S9T22253

language of work or name

English

title

2-ethylbutyl acetate (English)

retrieved

14 October 2016

ECHA Substance Infocard ID

100.030.075

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.030.075

retrieved

27 December 2018

title

2-ethylbutyl acetate (English)

quotation

CAS no.: 10031-87-5 (English)

FL number

09.025

1 reference

quotation

CAS no.: 10031-87-5 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

09.025

AICS Chemical ID (BEING DELETED)

12368

0 references

Human Metabolome Database ID

HMDB0031703

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

UNII

R7S9T22253

2 references

stated in

Global Substance Registration System

UNII

R7S9T22253

language of work or name

English

title

2-ethylbutyl acetate (English)

retrieved

14 October 2016

matched by identifier from

InChIKey

InChIKey

HQLKZWRSOHTERR-UHFFFAOYSA-N

Google Knowledge Graph ID

/g/11b7l8fg3s

0 references

JECFA database ID

323

0 references

JECFA number

140

1 reference

stated in

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

retrieved

13 May 2021

 

Sitelinks

Wikipedia(1 entry)

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• dewiki Essigsäure-2-ethylbutylester

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Wikisource(0 entries)

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Wikiversity(0 entries)

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Wikivoyage(0 entries)

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Wiktionary(0 entries)

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Multilingual sites(0 entries)

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