2-naphthalenethiol (Q9549728)

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chemical compound

• 2-Naphthalenethiol
• naphthalene-2-thiol

edit

Language	Label	Description	Also known as
English	2-naphthalenethiol	chemical compound	2-Naphthalenethiol naphthalene-2-thiol

Statements

instance of

type of chemical entity

0 references

subclass of

naphthalenes

1 reference

based on heuristic

inferred from SMILES

chemical structure

2-naphthalenethiol.png
1,432 × 686; 47 KB

0 references

mass

160.034671256 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₀H₈S

1 reference

PubChem CID

7058

retrieved

19 May 2021

canonical SMILES

C1=CC=C2C=C(C=CC2=C1)S

1 reference

PubChem CID

7058

retrieved

19 May 2021

melting point

81 degree Celsius

1 reference

stated in

Jean-Claude Bradley Open Melting Point Dataset

Commons category

2-Naphthalenethiol

0 references

Identifiers

InChI

InChI=1S/C10H8S/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H

1 reference

PubChem CID

7058

retrieved

19 May 2021

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

1 reference

PubChem CID

7058

retrieved

19 May 2021

CAS Registry Number

91-60-1

2 references

imported from Wikimedia project

Portuguese Wikipedia

stated in

CAS (formerly Chemical Abstracts Service)

retrieved

25 January 2022

ChemSpider ID

6791

0 references

PubChem CID

7058

2 references

retrieved

19 May 2021

matched by identifier from

InChIKey

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

ChEBI ID

173688

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C10H8S/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H

SureChEMBL ID

SCHEMBL76333

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

UniChem compound ID

23715179

1 reference

stated in

UniChem

NMRShiftDB structure ID

20202493

1 reference

matched by identifier from

InChIKey

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

DSSTox substance ID

DTXSID1059028

1 reference

matched by identifier from

InChIKey

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID9048720

0 references

NSC number

4749

0 references

EC number

202-082-5

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.001.893

retrieved

27 December 2018

title

Naphthalene-2-thiol (English)

quotation

CAS no.: 91-60-1 (English)

ECHA Substance Infocard ID

100.001.893

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.001.893

retrieved

27 December 2018

title

Naphthalene-2-thiol (English)

quotation

CAS no.: 91-60-1 (English)

FL number

12.033

1 reference

quotation

CAS no.: 91-60-1 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

12.033

AICS Chemical ID (BEING DELETED)

1692

0 references

Human Metabolome Database ID

HMDB0029689

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

UNII

SZ5U1S741V

1 reference

matched by identifier from

InChIKey

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

Google Knowledge Graph ID

/g/1203nh03c

0 references

JECFA database ID

3747

0 references

JECFA number

531

1 reference

stated in

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

retrieved

13 May 2021

 

Sitelinks

Wikipedia(5 entries)

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• dewiki 2-Naphthalinthiol
• enwiki 2-Naphthalenethiol
• jawiki 2-ナフタレンチオール
• ptwiki 2-Naftil mercaptano
• tawiki 2-நாப்தலீன்தயோல்

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-Naphthalenethiol

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