2-pentyl butyrate (Q27285351)

From Wikidata

Jump to navigation Jump to search

chemical compound

edit

Language	Label	Description	Also known as
English	2-pentyl butyrate	chemical compound

Statements

instance of

type of chemical entity

0 references

subclass of

biogenic acyclic ester

0 references

wax monoester

0 references

chemical structure

Pentyl butyrate.svg
572 × 172; 6 KB

0 references

image of molecular model or crystal lattice model

CalotteMd Pentylbutanoat.png
506 × 434; 37 KB

depicts

space-filling model

0 references

mass

158.131±0 dalton

1 reference

stated in

PubChem

PubChem CID

43263

language of work or name

English

title

pentan-2-yl butanoate (English)

retrieved

14 October 2016

chemical formula

C₉H₁₈O₂

1 reference

stated in

PubChem

PubChem CID

43263

language of work or name

English

title

pentan-2-yl butanoate (English)

retrieved

14 October 2016

canonical SMILES

CCCC(C)OC(=O)CCC

1 reference

stated in

PubChem

PubChem CID

43263

language of work or name

English

title

pentan-2-yl butanoate (English)

retrieved

14 October 2016

found in taxon

Vergonis planta

1 reference

stated in

The chemistry of food flavour. I. Volatile constituents of passionfruit, Passiflora edulis

Prostanthera lasianthos

1 reference

stated in

Comparing essential oils from Australia's 'Victorian Christmas Bush' (Prostanthera lasianthos Labill., Lamiaceae) to closely allied new species: Phenotypic plasticity and taxonomic variability

Identifiers

InChI

InChI=1S/C9H18O2/c1-4-6-8(3)11-9(10)7-5-2/h8H,4-7H2,1-3H3

1 reference

stated in

PubChem

PubChem CID

43263

language of work or name

English

title

pentan-2-yl butanoate (English)

retrieved

14 October 2016

InChIKey

DJOCFLQKCMWABC-UHFFFAOYSA-N

1 reference

stated in

PubChem

PubChem CID

43263

language of work or name

English

title

pentan-2-yl butanoate (English)

retrieved

14 October 2016

CAS Registry Number

60415-61-4

2 references

stated in

Global Substance Registration System

UNII

O5709B244U

language of work or name

English

title

2-pentyl butyrate (English)

retrieved

14 October 2016

InChIKey

DJOCFLQKCMWABC-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=60415-61-4

ChemSpider ID

39430

1 reference

stated in

ChemSpider

ChemSpider ID

39430

language of work or name

English

title

2-Pentanyl butyrate (English)

retrieved

14 October 2016

PubChem CID

43263

1 reference

stated in

PubChem

PubChem CID

43263

language of work or name

English

title

pentan-2-yl butanoate (English)

retrieved

14 October 2016

ChEBI ID

179875

mapping relation type

exact match

1 reference

stated in

ChEBI release 2022-06-13

UniChem compound ID

24089346

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP008563

0 references

SPLASH

splash10-00dl-9000000000-20b64b354a214dfa86bc

0 references

DSSTox substance ID

DTXSID50866810

0 references

DSSTOX compound identifier

DTXCID00815050

0 references

EC number

262-226-8

1 reference

stated in

Global Substance Registration System

UNII

O5709B244U

language of work or name

English

title

2-pentyl butyrate (English)

retrieved

14 October 2016

ECHA Substance Infocard ID

100.056.552

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.056.552

retrieved

27 December 2018

title

Isopentyl butyrate (English)

quotation

CAS no.: 60415-61-4 (English)

FL number

09.658

1 reference

quotation

CAS no.: 60415-61-4 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

09.658

AICS Chemical ID (BEING DELETED)

21105

0 references

Human Metabolome Database ID

HMDB0039219

1 reference

based on heuristic

inferred from InChIKey

UNII

O5709B244U

1 reference

stated in

Global Substance Registration System

UNII

O5709B244U

language of work or name

English

title

2-pentyl butyrate (English)

retrieved

14 October 2016

LIPID MAPS ID

LMFA07010712

1 reference

stated in

LIPID MAPS

reference URL

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

retrieved

30 June 2018

JECFA number

1142

1 reference

stated in

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

retrieved

13 May 2021

 

Sitelinks

Wikipedia(0 entries)

edit

Wikibooks(0 entries)

edit

Wikinews(0 entries)

edit

Wikiquote(0 entries)

edit

Wikisource(0 entries)

edit

Wikiversity(0 entries)

edit

Wikivoyage(0 entries)

edit

Wiktionary(0 entries)

edit

Multilingual sites(0 entries)

edit

Retrieved from "https://www.wikidata.org/w/index.php?title=Q27285351&oldid=2136366957"