isobutyl isovalerate (Q27161264)

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chemical compound

Isobutyl isopentanoate
Butanoic acid, 3-methyl-, 2-methylpropyl ester
Isovaleric acid, isobutyl ester
Isobutyl isovalerate
Isobutylisovalerate
2-Methylpropyl 3-methylbutyrate
Isobutyl 3-methylbutanoate
FEMA 3369
2-Methylpropyl isovalerate
2-Methylpropyl-3-methylbutyrate
Isobutyl 3-methylpropanoate

Language	Label	Description	Also known as
English	isobutyl isovalerate	chemical compound	Isobutyl isopentanoate Butanoic acid, 3-methyl-, 2-methylpropyl ester Isovaleric acid, isobutyl ester Isobutyl isovalerate Isobutylisovalerate 2-Methylpropyl 3-methylbutyrate Isobutyl 3-methylbutanoate FEMA 3369 2-Methylpropyl isovalerate 2-Methylpropyl-3-methylbutyrate Isobutyl 3-methylpropanoate

Statements

type of chemical entity

0 references

biogenic acyclic ester

0 references

0 references

158.131±0 dalton

1 reference

language of work or name

589-59-3 (English)

9 October 2016

chemical formula

C₉H₁₈O₂

1 reference

language of work or name

589-59-3 (English)

19 November 2016

canonical SMILES

CC(C)CC(=O)OCC(C)C

1 reference

language of work or name

589-59-3 (English)

19 November 2016

168.55 degree Celsius

101.325 kilopascal

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

Eucalyptus angulosa

1 reference

Volatile leaf oils of some south-western and southern australian species of the genus eucalyptus. Part I: Subgenus symphyomyrtus, section dumaria, series incrassatae

Eucalyptus behriana

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus ceratocorys

1 reference

Volatile leaf oils of some south-western and southern australian species of the genus eucalyptus. Part I: Subgenus symphyomyrtus, section dumaria, series incrassatae

Eucalyptus cuprea

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus dolichorhyncha

1 reference

Volatile leaf oils of some south-western and southern australian species of the genus eucalyptus. Part I: Subgenus symphyomyrtus, section dumaria, series incrassatae

Eucalyptus fasciculosa

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus forrestiana

1 reference

Volatile leaf oils of some south-western and southern australian species of the genus eucalyptus. Part I: Subgenus symphyomyrtus, section dumaria, series incrassatae

Eucalyptus incrassata

1 reference

Volatile leaf oils of some south-western and southern australian species of the genus eucalyptus. Part I: Subgenus symphyomyrtus, section dumaria, series incrassatae

Eucalyptus intertexta

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus lansdowneana

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus leucoxylon

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus melanophloia

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus ochrophloia

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus odorata

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus populnea

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus porosa

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus sparsa

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Eucalyptus stoatei

1 reference

Volatile leaf oils of some south-western and southern australian species of the genus eucalyptus. Part I: Subgenus symphyomyrtus, section dumaria, series incrassatae

Eucalyptus tetraptera

1 reference

Volatile leaf oils of some south-western and southern australian species of the genus eucalyptus. Part I: Subgenus symphyomyrtus, section dumaria, series incrassatae

Eucalyptus viridis

1 reference

Volatile leaf oils of some South-western and Southern Australian species of the genusEucalyptus part VI—subgenus symphyomyrtus, section adnataria

Humulus lupulus

1 reference

Direct thermal desorption-gas chromatography and gas chromatography-mass spectrometry profiling of hop (Humulus lupulus L.) essential oils in support of varietal characterization

Identifiers

InChI=1S/C9H18O2/c1-7(2)5-9(10)11-6-8(3)4/h7-8H,5-6H2,1-4H3

1 reference

language of work or name

589-59-3 (English)

19 November 2016

KEBDNKNVCHQIJU-UHFFFAOYSA-N

2 references

language of work or name

589-59-3 (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

isobutyl isovalerate (English)

19 November 2016

CAS Common Chemistry

7 April 2021

https://commonchemistry.cas.org/detail?cas_rn=589-59-3

KEBDNKNVCHQIJU-UHFFFAOYSA-N

1 reference

language of work or name

Isobutyl isovalerate (English)

9 October 2016

1 reference

language of work or name

589-59-3 (English)

19 November 2016

mapping relation type

2 references

language of work or name

2-Methylpropyl 3-methylbutanoate (English)

9 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C9H18O2/c1-7(2)5-9(10)11-6-8(3)4/h7-8H,5-6H2,1-4H3

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KEBDNKNVCHQIJU-UHFFFAOYSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP006522

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MSBNK-Fac_Eng_Univ_Tokyo-JP005213

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MSBNK-Fac_Eng_Univ_Tokyo-JP005300

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splash10-0a4r-9000000000-1e5622a34261a1d42c75

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splash10-0a4r-9000000000-336ea180a0659bc877c5

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DSSTox substance ID

1 reference

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

DSSTOX compound identifier

0 references

0 references

209-653-8

1 reference

Global Substance Registration System

language of work or name

isobutyl isovalerate (English)

19 November 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Isobutyl isovalerate (English)

CAS no.: 589-59-3 (English)

09.472

1 reference

CAS no.: 589-59-3 (English)

23 January 2021

09.472

1 reference

CosIng database

28 December 2019

ISOBUTYL ISOVALERATE (English)

CAS no.: 589-59-3 (English)

AICS Chemical ID (BEING DELETED)

0 references

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KEBDNKNVCHQIJU-UHFFFAOYSA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KEBDNKNVCHQIJU-UHFFFAOYSA-N

2 references

Global Substance Registration System

language of work or name

isobutyl isovalerate (English)

19 November 2016

matched by identifier from

KEBDNKNVCHQIJU-UHFFFAOYSA-N

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

30 June 2018

JECFA database ID

0 references

203

1 reference

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

13 May 2021

Sitelinks

Wikipedia(1 entry)

eowiki Izobutila izovalerato

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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