cyclohexanecarboxylic acid (Q5198713)

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chemical compound

• cyclohexylformic acid
• cyclohexanoic acid
• cyclohexylmethanoic acid
• carboxycyclohexane
• cyclohexylcarboxylic acid
• Cyclohexanecarboxylic acid
• FEMA 3531
• Hexahydro-Benzoic acid
• Naphthenic acid
• Cyclohexane-1-carboxylate
• 7549-42-0 (Calcium salt)
• Naphthenoic acid

edit

Language	Label	Description	Also known as
English	cyclohexanecarboxylic acid	chemical compound	cyclohexylformic acid cyclohexanoic acid cyclohexylmethanoic acid carboxycyclohexane cyclohexylcarboxylic acid Cyclohexanecarboxylic acid FEMA 3531 Hexahydro-Benzoic acid Naphthenic acid Cyclohexane-1-carboxylate 7549-42-0 (Calcium salt) Naphthenoic acid

Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

chemical structure

Cyclohexanecarboxylic acid 200.svg
125 × 99; 3 KB

1 reference

imported from Wikimedia project

German Wikipedia

Cyclohexanecarboxylic acid.svg
512 × 404; 8 KB

0 references

mass

128.084 dalton

1 reference

stated in

PubChem

PubChem CID

7413

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

chemical formula

C₇H₁₂O₂

1 reference

stated in

PubChem

PubChem CID

7413

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

canonical SMILES

C1CCC(CC1)C(=O)O

1 reference

stated in

PubChem

PubChem CID

7413

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

melting point

31.0 degree Celsius

1 reference

stated in

Jean-Claude Bradley Open Melting Point Dataset

found in taxon

Alicyclobacillus acidocaldarius

1 reference

stated in

Biosynthesis of the cyclohexanecarboxylic acid starter unit of .omega.-cyclohexyl fatty acids in Alicyclobacillus acidocaldarius

Streptomyces collinus

1 reference

stated in

Biosynthesis of the ansamycin antibiotic ansatrienin (mycotrienin) by Streptomyces collinus

Commons category

Cyclohexanecarboxylic acid

0 references

Identifiers

InChI

InChI=1S/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9)

1 reference

stated in

PubChem

PubChem CID

7413

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

7413

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

98-89-5

2 references

stated in

ChEBI

ChEBI ID

36096

language of work or name

English

title

cyclohexanecarboxylic acid (English)

retrieved

5 October 2016

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

10 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=98-89-5

ChemSpider ID

7135

1 reference

stated in

ChemSpider

ChemSpider ID

7135

language of work or name

English

title

Hexahydrobenzoic acid (English)

retrieved

5 October 2016

PubChem CID

7413

2 references

stated in

PubChem

PubChem CID

7413

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

matched by identifier from

InChIKey

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

Reaxys registry number

970529

1 reference

stated in

ChEBI

ChEBI ID

36096

language of work or name

English

title

cyclohexanecarboxylic acid (English)

retrieved

5 October 2016

Gmelin number

50010

0 references

ChEBI ID

36096

mapping relation type

exact match

2 references

stated in

ChEBI

ChEBI ID

36096

language of work or name

English

title

cyclohexanecarboxylic acid (English)

retrieved

5 October 2016

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9)

SureChEMBL ID

SCHEMBL6501

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

UniChem compound ID

1067595

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP010328

0 references

MSBNK-Keio_Univ-KO000539

0 references

MSBNK-Keio_Univ-KO000540

0 references

MSBNK-Keio_Univ-KO000541

0 references

MSBNK-Keio_Univ-KO000542

0 references

MSBNK-Keio_Univ-KO000543

0 references

SPLASH

splash10-004i-0900000000-69422c2f22908125487e

0 references

splash10-004i-1900000000-2b1c359177d442da9138

0 references

splash10-056s-9500000000-8b79211c98aa33e6b31a

0 references

splash10-0a4i-9000000000-a73dd06af262b4a9ef25

0 references

splash10-0006-9000000000-0018f47571feaf232ff8

0 references

NMRShiftDB structure ID

20202458

1 reference

matched by identifier from

InChIKey

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

ZVG number

10170

0 references

DSSTox substance ID

DTXSID8059180

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID1049063

0 references

NSC number

452

0 references

EC number

202-711-3

1 reference

stated in

Global Substance Registration System

UNII

H9VKD9VL18

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

ECHA Substance Infocard ID

100.002.465

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.002.465

retrieved

27 December 2018

title

Cyclohexanecarboxylic acid (English)

quotation

CAS no.: 98-89-5 (English)

FL number

08.060

1 reference

quotation

CAS no.: 98-89-5 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

08.060

CosIng number

39428

1 reference

stated in

CosIng database

CosIng number

39428

retrieved

28 December 2019

title

CYCLOHEXANECARBOXYLIC ACID (English)

quotation

CAS no.: 98-89-5 (English)

Human Metabolome Database ID

HMDB0031342

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

KNApSAcK ID

C00000334

3 references

stated in

ChEBI

ChEBI ID

36096

language of work or name

English

title

cyclohexanecarboxylic acid (English)

retrieved

5 October 2016

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

UNII

H9VKD9VL18

2 references

stated in

Global Substance Registration System

UNII

H9VKD9VL18

language of work or name

English

title

CYCLOHEXANECARBOXYLIC ACID (English)

retrieved

5 October 2016

matched by identifier from

InChIKey

InChIKey

NZNMSOFKMUBTKW-UHFFFAOYSA-N

Probes And Drugs ID

PD124012

0 references

KEGG ID

C09822

0 references

CAB ID

103380

1 reference

stated in

CAB Thesaurus

retrieved

6 April 2020

Freebase ID

/m/0dv1l_

0 references

JECFA number

961

1 reference

stated in

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

retrieved

13 May 2021

Microsoft Academic ID

2779591131

0 references

OpenAlex ID

C2779591131

1 reference

stated in

OpenAlex

retrieved

26 January 2022

reference URL

https://docs.openalex.org/download-snapshot/snapshot-data-format

 

Sitelinks

Wikipedia(7 entries)

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• dewiki Cyclohexancarbonsäure
• enwiki Cyclohexanecarboxylic acid
• fiwiki Sykloheksaanikarboksyylihappo
• jawiki シクロヘキサンカルボン酸
• shwiki Cikloheksankarboksilna kiselina
• srwiki Cikloheksankarboksilna kiselina
• zhwiki 环己烷甲酸

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:Cyclohexanecarboxylic acid

Retrieved from "https://www.wikidata.org/w/index.php?title=Q5198713&oldid=2294974272"