2-Phenethyl propionate (Q4596915)

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chemical compound

• phenethyl propanoate or phenylethyl propionate

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Language	Label	Description	Also known as
English	2-Phenethyl propionate	chemical compound	phenethyl propanoate or phenylethyl propionate

Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

chemical structure

Phenethyl propionate.png
769 × 257; 5 KB

0 references

mass

178.099379688 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₁H₁₄O₂

1 reference

stated in

PubChem

canonical SMILES

O=C(OC(c1ccccc1)C)CC

1 reference

imported from Wikimedia project

English Wikipedia

CCC(=O)OCCc1ccccc1

0 references

found in taxon

Pelargonium endlicherianum

1 reference

stated in

The analysis of essential oil and headspace volatiles of the flowers of Pelargonium endlicherianum used as an anthelmintic in folk medicine

Eucalyptus bridgesiana

1 reference

stated in

Volatile Constituents of the Essential Oil ofEucalyptus bridgesianaGrowing in India

Eucalyptus populnea

1 reference

stated in

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

Eucalyptus sparsa

1 reference

stated in

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

Eucalyptus cuprea

1 reference

stated in

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

Eucalyptus behriana

1 reference

stated in

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

Eucalyptus intertexta

1 reference

stated in

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

Eucalyptus ochrophloia

1 reference

stated in

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

Eucalyptus porosa

1 reference

stated in

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

Eucalyptus viridis

1 reference

stated in

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

Eucalyptus melanophloia

1 reference

stated in

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

Eucalyptus fasciculosa

1 reference

stated in

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

Eucalyptus leucoxylon

1 reference

stated in

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

Eucalyptus lansdowneana

1 reference

stated in

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

Eucalyptus odorata

1 reference

stated in

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

Chamaemelum nobile

1 reference

stated in

Novel Ketones from Roman Camomile Oil

Identifiers

InChI

InChI=1S/C11H14O2/c1-2-11(12)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3

1 reference

stated in

PubChem

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

1 reference

stated in

PubChem

CAS Registry Number

122-70-3

2 references

imported from Wikimedia project

English Wikipedia

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=122-70-3

ChemSpider ID

8125

1 reference

imported from Wikimedia project

English Wikipedia

PubChem CID

31225

2 references

imported from Wikimedia project

English Wikipedia

matched by identifier from

InChIKey

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

ChEBI ID

173825

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C11H14O2/c1-2-11(12)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3

SureChEMBL ID

SCHEMBL114088

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

UniChem compound ID

1164020

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP008372

0 references

SPLASH

splash10-0zfr-9800000000-234d53df7898caf22a51

0 references

NMRShiftDB structure ID

10008969

1 reference

matched by identifier from

InChIKey

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

HSDB ID

7428

1 reference

stated in

Hazardous Substances Data Bank

HSDB ID

7428

publication date

28 October 2019

title

2-PHENYLETHYL PROPIONATE (English)

retrieved

10 May 2021

DSSTox substance ID

DTXSID6035156

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID4015156

0 references

NSC number

404457

0 references

EC number

204-567-7

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.004.153

retrieved

27 December 2018

title

Phenethyl propionate (English)

quotation

CAS no.: 122-70-3 (English)

ECHA Substance Infocard ID

100.004.153

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.004.153

retrieved

27 December 2018

title

Phenethyl propionate (English)

quotation

CAS no.: 122-70-3 (English)

FL number

09.137

1 reference

quotation

CAS no.: 122-70-3 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

09.137

CosIng number

40611

1 reference

stated in

CosIng database

CosIng number

40611

retrieved

28 December 2019

title

PHENETHYL PROPIONATE (English)

quotation

CAS no.: 122-70-3 (English)

PesticideInfo chemical ID

PRI4913

0 references

AICS Chemical ID (BEING DELETED)

3455

0 references

Human Metabolome Database ID

HMDB0035013

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

KNApSAcK ID

C00056663

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

UNII

9VFI60EUHW

1 reference

matched by identifier from

InChIKey

InChIKey

HVGZQCSMLUDISR-UHFFFAOYSA-N

CAB ID

241896

1 reference

stated in

CAB Thesaurus

retrieved

6 April 2020

Freebase ID

/m/043jq7g

0 references

JECFA number

990

1 reference

stated in

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

retrieved

13 May 2021

 

Sitelinks

Wikipedia(7 entries)

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• azbwiki ۲-فنتیل پروپیونات
• enwiki 2-Phenethyl propionate
• eowiki Fenetila propionato
• fawiki ۲-فنتیل پروپیونات
• shwiki 2-Fenetil propionat
• srwiki 2-Fenetil propionat
• tawiki 2-பீனெத்தில் புரோப்பியோனேட்டு

Wikibooks(0 entries)

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Wikinews(0 entries)

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Wikiquote(0 entries)

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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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