(Q1193173)

Ethyl pentanoate (English)

9 October 2016

chemical formula

C₇H₁₄O₂

1 reference

Ethyl pentanoate (English)

19 November 2016

canonical SMILES

CCCCC(=O)OCC

1 reference

Ethyl pentanoate (English)

19 November 2016

melting point

−91.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

safety classification and labelling

NFPA 704: Standard System for the Identification of the Hazards of Materials for Emergency Response

0

3

0

no value

1 reference

reference URL

https://www.sigmaaldrich.com/MSDS/MSDS/DisplayMSDSPage.do?country=US&language=en&productNumber=W246204&brand=ALDRICH&PageToGoToURL=https://www.sigmaaldrich.com/catalog/search?term=539-82-2&interface=All&N=0&mode=partialmax&lang=pl®ion=PL&focus=product&F=PR&ST=RS&N3=mode%20matchpartialmax&N5=All

publisher

Sigma-Aldrich

Ethyl valerate (English)

point in time

9 July 2014

14 July 2018

The essential oil in lamina and petiole of Heracleum dissectum leaves

1 reference

Nepeta nepetella

1 reference

Constituents of Essential Oil of Nepeta nepetella

Polygala senega

1 reference

Volatile compounds ofPolygala senega L. var.latifolia Torrey et Gray roots

Pyrus pyrifolia

1 reference

Volatiles of Ripe Asian Pears (Pyrus serotinaRehder)

tomato

1 reference

Effect of autochthonous lactic acid bacteria starters on health-promoting and sensory properties of tomato juices

Mimusops elengi

1 reference

Volatile Components of Mimusops elengi L. Flowers

Philotheca trachyphylla

1 reference

The constituents of Eriostemon trachyphyllus. The structure of trachyphyllin, a new coumarin

Passiflora edulis

1 reference

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

Commons category

Ethyl pentanoate

0 references

Identifiers

InChI

InChI=1S/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3

1 reference

Ethyl pentanoate (English)

19 November 2016

2 references

Ethyl pentanoate (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

539-82-2

2 references

ethyl valerate (English)

19 November 2016

https://commonchemistry.cas.org/detail?cas_rn=539-82-2

9 April 2021

1 reference

Ethyl valerate (English)

19 November 2016

2 references

Ethyl pentanoate (English)

19 November 2016

ChEBI ID

89771

mapping relation type

2 references

CHEMBL47483 (English)

19 November 2016

International Chemical Identifier

InChI

InChI=1S/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3

1 reference

CHEMBL47483 (English)

19 November 2016

2 references

inferred from InChIKey

MSBNK-Fac_Eng_Univ_Tokyo-JP005297

1 reference

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP007225

0 references

SPLASH

splash10-002r-9500000000-909ffa0990cafcc628c8

0 references

NMRShiftDB structure ID

20200165

1 reference

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

0 references

2 references

DSSTOX compound identifier

0 references

0 references

1 reference

ethyl valerate (English)

ECHA Substance Infocard ID

19 November 2016

100.007.934

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.007.934

27 December 2018

Ethyl valerate (English)

quotation

CAS no.: 539-82-2 (English)

FL number

09.147

1 reference

quotation

CAS no.: 539-82-2 (English)

23 January 2021

09.147

1 reference

28 December 2019

ETHYL VALERATE (English)

quotation

CAS no.: 539-82-2 (English)

RxNorm ID

1312574

1 reference

ethyl valerate (English)

Human Metabolome Database ID

19 November 2016

HMDB0040297

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00062125

2 references

based on heuristic

inferred from InChIKey

2 references

ethyl valerate (English)

19 November 2016

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

1 reference

30 June 2018

1 reference

28 October 2013

0 references

30

1 reference

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