methyl nonanoate (Q3343334)

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chemical compound

• Pelargonic acid methyl ester
• Methyl n-nonanoate
• Methyl ester nonanoic acid
• Methyl nonylate
• Methyl pelargonate
• 1-nonanecarboxylic acid
• Methyl Nonanoate (Ester)

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Language	Label	Description	Also known as
English	methyl nonanoate	chemical compound	Pelargonic acid methyl ester Methyl n-nonanoate Methyl ester nonanoic acid Methyl nonylate Methyl pelargonate 1-nonanecarboxylic acid Methyl Nonanoate (Ester)

Statements

instance of

type of chemical entity

0 references

subclass of

biogenic acyclic ester

0 references

wax monoester

0 references

chemical structure

Structural formula of methyl nonanoate.svg
535 × 116; 8 KB

0 references

Skeletal formula of methyl nonanoate.svg
449 × 116; 5 KB

0 references

mass

172.146±0 dalton

1 reference

stated in

PubChem

PubChem CID

15606

language of work or name

English

title

METHYL NONANOATE (English)

retrieved

19 October 2016

chemical formula

C₁₀H₂₀O₂

1 reference

stated in

PubChem

PubChem CID

15606

language of work or name

English

title

METHYL NONANOATE (English)

retrieved

19 November 2016

canonical SMILES

CCCCCCCCC(=O)OC

1 reference

stated in

PubChem

PubChem CID

15606

language of work or name

English

title

METHYL NONANOATE (English)

retrieved

19 November 2016

found in taxon

Astragalus membranaceus

1 reference

stated in

Volatile Flavor Components of ASTRAGALI RADIX (Astragalus membranaceusBunge)

Daphne odora

1 reference

stated in

Volatile components of zinchoge flower (Daphne odora Thunb.).

Olea europaea

1 reference

stated in

Analysis of volatiles from callus cultures of olive Olea europaea

Polygala senega

1 reference

stated in

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

Akebia trifoliata

1 reference

stated in

Constituents of essential oil from the dried fruits and stems of Akebia quinata (THUNB.) DECNE.

celery

1 reference

stated in

COMPOSITION AND ANTIMICROBIAL ACTIVITY OF CELERY (APIUM GRAVEOLENS) LEAF AND ROOT EXTRACTS OBTAINED WITH LIQUID CARBON DIOXIDE

Astragalus trimestris

1 reference

stated in

Volatile Flavor Components of ASTRAGALI RADIX (Astragalus membranaceusBunge)

Astragalus mongholicus

1 reference

stated in

Volatile Flavor Components of ASTRAGALI RADIX (Astragalus membranaceusBunge)

Aristolochiaceae

1 reference

stated in

Two Dibenzylbutyrolactol Derivatives and Other Chemical Constituents from Aristolochia peltato-deltoidea

Commons category

Methyl nonanoate

0 references

Identifiers

InChI

InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3

1 reference

stated in

PubChem

PubChem CID

15606

language of work or name

English

title

METHYL NONANOATE (English)

retrieved

19 November 2016

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

15606

language of work or name

English

title

METHYL NONANOATE (English)

retrieved

19 November 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

1731-84-6

2 references

stated in

Global Substance Registration System

UNII

7XKD6QOH68

language of work or name

English

title

methyl nonanoate (English)

retrieved

19 November 2016

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=1731-84-6

ChemSpider ID

14846

1 reference

stated in

ChemSpider

ChemSpider ID

14846

language of work or name

English

title

Methyl nonanoate (English)

retrieved

19 November 2016

PubChem CID

15606

2 references

stated in

PubChem

PubChem CID

15606

language of work or name

English

title

METHYL NONANOATE (English)

retrieved

19 November 2016

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

Reaxys registry number

1754521

1 reference

stated in

ChEBI

ChEBI ID

44499

language of work or name

English

title

methyl nonanoate (English)

retrieved

19 October 2016

ChEBI ID

44499

mapping relation type

exact match

2 references

stated in

ChEBI

ChEBI ID

44499

language of work or name

English

title

methyl nonanoate (English)

retrieved

19 October 2016

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3

SureChEMBL ID

SCHEMBL309872

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

UniChem compound ID

652156

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP006245

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP007006

0 references

SPLASH

splash10-00di-9000000000-6b14d9620e385334bcce

0 references

splash10-000i-9500000000-7cc501def8f3d350c53a

0 references

splash10-000i-9300000000-0fea4fadc7a2a00ae423

0 references

NMRShiftDB structure ID

20025083

1 reference

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

ZVG number

494063

0 references

DSSTox substance ID

DTXSID8061921

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID6035522

0 references

EC number

217-052-7

1 reference

stated in

Global Substance Registration System

UNII

7XKD6QOH68

language of work or name

English

title

methyl nonanoate (English)

retrieved

19 November 2016

ECHA Substance Infocard ID

100.015.502

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.015.502

retrieved

27 December 2018

title

Methyl nonanoate (English)

quotation

CAS no.: 1731-84-6 (English)

FL number

09.108

1 reference

quotation

CAS no.: 1731-84-6 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

09.108

CosIng number

35320

1 reference

stated in

CosIng database

CosIng number

35320

retrieved

28 December 2019

title

METHYL PELARGONATE (English)

quotation

CAS no.: 1731-84-6 (English)

AICS Chemical ID (BEING DELETED)

7055

0 references

DrugBank ID

DB01631

1 reference

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

Human Metabolome Database ID

HMDB0031264

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

KNApSAcK ID

C00049004

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

UNII

7XKD6QOH68

2 references

stated in

Global Substance Registration System

UNII

7XKD6QOH68

language of work or name

English

title

methyl nonanoate (English)

retrieved

19 November 2016

matched by identifier from

InChIKey

InChIKey

IJXHLVMUNBOGRR-UHFFFAOYSA-N

Probes And Drugs ID

PD008905

0 references

LIPID MAPS ID

LMFA07010963

1 reference

stated in

LIPID MAPS

reference URL

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

retrieved

30 June 2018

PDB ligand ID

NON

0 references

Google Knowledge Graph ID

/g/1214fy92

0 references

JECFA database ID

2818

0 references

JECFA number

179

1 reference

stated in

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

retrieved

13 May 2021

PDB structure ID

1CLY

1 reference

stated in

Protein Data Bank

PDB structure ID

1CLY

language of work or name

English

title

1CLY (English)

retrieved

19 October 2016

1CLZ

1 reference

stated in

Protein Data Bank

PDB structure ID

1CLZ

language of work or name

English

title

1CLZ (English)

retrieved

19 October 2016

 

Sitelinks

Wikipedia(2 entries)

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• dewiki Pelargonsäuremethylester
• frwiki Nonanoate de méthyle

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(1 entry)

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• commonswiki Category:Methyl nonanoate

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