2,2,2-trifluoroethanol (Q2474643)

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chemical compound

• 2,2,2-trifluoroethyl alcohol
• TFE
• trifluoroethanol

edit

Language	Label	Description	Also known as
English	2,2,2-trifluoroethanol	chemical compound	2,2,2-trifluoroethyl alcohol TFE trifluoroethanol

Statements

instance of

type of chemical entity

0 references

subclass of

organofluorine

0 references

primary alcohol

0 references

chemical structure

2,2,2-trifluoroethanol.svg
209 × 126; 6 KB

1 reference

imported from Wikimedia project

German Wikipedia

mass

100.014 dalton

1 reference

stated in

PubChem

PubChem CID

6409

language of work or name

English

title

2,2,2-TRIFLUOROETHANOL (English)

retrieved

17 November 2016

chemical formula

C₂H₃F₃O

1 reference

stated in

PubChem

PubChem CID

6409

language of work or name

English

title

2,2,2-TRIFLUOROETHANOL (English)

retrieved

17 November 2016

canonical SMILES

C(C(F)(F)F)O

1 reference

stated in

PubChem

PubChem CID

6409

language of work or name

English

title

2,2,2-TRIFLUOROETHANOL (English)

retrieved

17 November 2016

melting point

−44 degree Celsius

1 reference

stated in

Jean-Claude Bradley Open Melting Point Dataset

pKa

12.37

temperature

25 degree Celsius

1 reference

stated in

Acid Ionization Constants of Alcohols. II. Acidities of Some Substituted Methanols and Related Compounds 1,2

safety classification and labelling

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

NFPA Health

2

NFPA Fire

3

NFPA Instability

1

NFPA Special

no value

1 reference

imported from Wikimedia project

English Wikipedia

global warming potential

24

duration

100 year

1 reference

stated in

Anthropogenic and Natural Radiative Forcing Supplementary Material

has part(s)

oxygen

0 references

fluorine

0 references

carbon

0 references

Commons category

2,2,2-Trifluoroethanol

0 references

Identifiers

InChI

InChI=1S/C2H3F3O/c3-2(4,5)1-6/h6H,1H2

1 reference

stated in

PubChem

PubChem CID

6409

language of work or name

English

title

2,2,2-TRIFLUOROETHANOL (English)

retrieved

17 November 2016

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

6409

language of work or name

English

title

2,2,2-TRIFLUOROETHANOL (English)

retrieved

17 November 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

75-89-8

2 references

stated in

Global Substance Registration System

UNII

8T8I76KYF1

language of work or name

English

title

2,2,2-trifluoroethanol (English)

retrieved

17 November 2016

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=75-89-8

ChemSpider ID

21106169

1 reference

stated in

ChemSpider

ChemSpider ID

21106169

language of work or name

English

title

2,2,2-Trifluoroethanol (English)

retrieved

17 November 2016

PubChem CID

6409

2 references

stated in

PubChem

PubChem CID

6409

language of work or name

English

title

2,2,2-TRIFLUOROETHANOL (English)

retrieved

17 November 2016

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

Reaxys registry number

1733203

1 reference

stated in

ChEBI

ChEBI ID

42330

language of work or name

English

title

2,2,2-trifluoroethanol (English)

retrieved

19 October 2016

Gmelin number

2532

0 references

ChEBI ID

42330

mapping relation type

exact match

2 references

stated in

ChEMBL

ChEMBL ID

CHEMBL116675

language of work or name

English

title

TRIFLUOROETHANOL (English)

retrieved

17 November 2016

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C2H3F3O/c3-2(4,5)1-6/h6H,1H2

ChEMBL ID

CHEMBL116675

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL116675

language of work or name

English

title

TRIFLUOROETHANOL (English)

retrieved

17 November 2016

UniChem compound ID

246133

1 reference

stated in

UniChem

NMRShiftDB structure ID

10008931

1 reference

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

RTECS number

KM5250000

1 reference

imported from Wikimedia project

French Wikipedia

ZVG number

492395

0 references

DSSTox substance ID

DTXSID0021751

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

DTXSID10893581

reason for deprecated rank

applies to other chemical entity

1 reference

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

DTXSID90893802

reason for deprecated rank

applies to other chemical entity

1 reference

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

DTXSID901024684

reason for deprecated rank

applies to other chemical entity

1 reference

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID401751

0 references

NSC number

451

0 references

EC number

200-913-6

1 reference

stated in

Global Substance Registration System

UNII

8T8I76KYF1

language of work or name

English

title

2,2,2-trifluoroethanol (English)

retrieved

17 November 2016

ECHA Substance Infocard ID

100.000.831

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.000.831

retrieved

27 December 2018

title

2,2,2-trifluoroethanol (English)

quotation

CAS no.: 75-89-8 (English)

MeSH descriptor ID

D014270

subject named as

Trifluoroethanol

0 references

MeSH tree code

D02.033.375.880

0 references

DrugBank ID

DB03226

1 reference

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

UNII

8T8I76KYF1

2 references

stated in

Global Substance Registration System

UNII

8T8I76KYF1

language of work or name

English

title

2,2,2-trifluoroethanol (English)

retrieved

17 November 2016

matched by identifier from

InChIKey

InChIKey

RHQDFWAXVIIEBN-UHFFFAOYSA-N

Probes And Drugs ID

PD007321

0 references

PDB ligand ID

ETF

0 references

Freebase ID

/m/07ngyc

1 reference

stated in

Freebase Data Dumps

publication date

28 October 2013

Microsoft Academic ID

2778314959

0 references

PDB structure ID

1YL1

1 reference

stated in

Protein Data Bank

PDB structure ID

1YL1

language of work or name

English

title

1YL1 (English)

retrieved

19 October 2016

2NUD

1 reference

stated in

Protein Data Bank

PDB structure ID

2NUD

language of work or name

English

title

2NUD (English)

retrieved

19 October 2016

2FOH

1 reference

stated in

Protein Data Bank

PDB structure ID

2FOH

language of work or name

English

title

2FOH (English)

retrieved

19 October 2016

2FOG

1 reference

stated in

Protein Data Bank

PDB structure ID

2FOG

language of work or name

English

title

2FOG (English)

retrieved

19 October 2016

5F9F

1 reference

stated in

Protein Data Bank

PDB structure ID

5F9F

language of work or name

English

title

5F9F (English)

retrieved

19 October 2016

4J6A

1 reference

stated in

Protein Data Bank

PDB structure ID

4J6A

language of work or name

English

title

4J6A (English)

retrieved

19 October 2016

4DXH

1 reference

stated in

Protein Data Bank

PDB structure ID

4DXH

language of work or name

English

title

4DXH (English)

retrieved

19 October 2016

1A71

1 reference

stated in

Protein Data Bank

PDB structure ID

1A71

language of work or name

English

title

1A71 (English)

retrieved

19 October 2016

5KJF

1 reference

stated in

Protein Data Bank

PDB structure ID

5KJF

language of work or name

English

title

5KJF (English)

retrieved

19 October 2016

5KCZ

1 reference

stated in

Protein Data Bank

PDB structure ID

5KCZ

language of work or name

English

title

5KCZ (English)

retrieved

19 October 2016

4NXY

1 reference

stated in

Protein Data Bank

PDB structure ID

4NXY

language of work or name

English

title

4NXY (English)

retrieved

19 October 2016

1P2S

1 reference

stated in

Protein Data Bank

PDB structure ID

1P2S

language of work or name

English

title

1P2S (English)

retrieved

19 October 2016

1RJW

1 reference

stated in

Protein Data Bank

PDB structure ID

1RJW

language of work or name

English

title

1RJW (English)

retrieved

19 October 2016

3RS2

1 reference

stated in

Protein Data Bank

PDB structure ID

3RS2

language of work or name

English

title

3RS2 (English)

retrieved

19 October 2016

5ENV

1 reference

stated in

Protein Data Bank

PDB structure ID

5ENV

language of work or name

English

title

5ENV (English)

retrieved

19 October 2016

3D71

1 reference

stated in

Protein Data Bank

PDB structure ID

3D71

language of work or name

English

title

3D71 (English)

retrieved

19 October 2016

3EV4

1 reference

stated in

Protein Data Bank

PDB structure ID

3EV4

language of work or name

English

title

3EV4 (English)

retrieved

19 October 2016

4W6Z

1 reference

stated in

Protein Data Bank

PDB structure ID

4W6Z

language of work or name

English

title

4W6Z (English)

retrieved

19 October 2016

1SBY

1 reference

stated in

Protein Data Bank

PDB structure ID

1SBY

language of work or name

English

title

1SBY (English)

retrieved

19 October 2016

1AXG

1 reference

stated in

Protein Data Bank

PDB structure ID

1AXG

language of work or name

English

title

1AXG (English)

retrieved

19 October 2016

1AXE

1 reference

stated in

Protein Data Bank

PDB structure ID

1AXE

language of work or name

English

title

1AXE (English)

retrieved

19 October 2016

4OYT

1 reference

stated in

Protein Data Bank

PDB structure ID

4OYT

language of work or name

English

title

4OYT (English)

retrieved

19 October 2016

4NFS

1 reference

stated in

Protein Data Bank

PDB structure ID

4NFS

language of work or name

English

title

4NFS (English)

retrieved

19 October 2016

UMLS CUI

C0040983

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

stated in

UMLS 2023

retrieved

24 May 2023

 

Sitelinks

Wikipedia(17 entries)

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• azbwiki ۲٬۲٬۲-تری‌فلوئورواتانول
• cawiki 2,2,2-Trifluoroetanol
• cswiki 2,2,2-trifluorethanol
• dewiki 2,2,2-Trifluorethanol
• enwiki 2,2,2-Trifluoroethanol
• fawiki ۲٬۲٬۲-تری‌فلوئورواتانول
• fiwiki Trifluorietanoli
• frwiki 2,2,2-Trifluoroéthanol
• hiwiki 2,2,2-ट्राइफ्लोरोइथेनॉल
• itwiki 2,2,2-Trifluoroetanolo
• jawiki 2,2,2-トリフルオロエタノール
• nlwiki 2,2,2-trifluorethanol
• ruwiki Трифторэтанол
• shwiki 2,2,2-Trifluoroetanol
• srwiki 2,2,2-Trifluoroetanol
• viwiki 2,2,2-Trifluoroethanol
• zhwiki 三氟乙醇

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:2,2,2-Trifluoroethanol

Retrieved from "https://www.wikidata.org/w/index.php?title=Q2474643&oldid=2294975005"