3-mercapto-3-methyl-1-butanol (Q14201168)

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chemical compound

• 3-Mercapto-3-methylbutan-1-ol

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Language	Label	Description	Also known as
English	3-mercapto-3-methyl-1-butanol	chemical compound	3-Mercapto-3-methylbutan-1-ol

Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

mass

120.061 dalton

1 reference

stated in

PubChem

PubChem CID

520682

language of work or name

English

title

3-Mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

chemical formula

C₅H₁₂OS

1 reference

stated in

PubChem

PubChem CID

520682

language of work or name

English

title

3-Mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

canonical SMILES

CC(C)(CCO)S

1 reference

stated in

PubChem

PubChem CID

520682

language of work or name

English

title

3-Mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

Identifiers

InChI

InChI=1S/C5H12OS/c1-5(2,7)3-4-6/h6-7H,3-4H2,1-2H3

1 reference

stated in

PubChem

PubChem CID

520682

language of work or name

English

title

3-Mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

InChIKey

GBCGIJAYTBMFHI-UHFFFAOYSA-N

1 reference

stated in

PubChem

PubChem CID

520682

language of work or name

English

title

3-Mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

CAS Registry Number

34300-94-2

2 references

stated in

Global Substance Registration System

UNII

1RF3LN9685

language of work or name

English

title

3-mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

InChIKey

GBCGIJAYTBMFHI-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=34300-94-2

ChemSpider ID

454169

1 reference

stated in

ChemSpider

ChemSpider ID

454169

language of work or name

English

title

3-Methyl-3-sulfanyl-1-butanol (English)

retrieved

14 October 2016

PubChem CID

520682

1 reference

stated in

PubChem

PubChem CID

520682

language of work or name

English

title

3-Mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

ChEBI ID

156142

mapping relation type

exact match

2 references

stated in

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C5H12OS/c1-5(2,7)3-4-6/h6-7H,3-4H2,1-2H3

UniChem compound ID

7005372

1 reference

stated in

UniChem

DSSTox substance ID

DTXSID50187870

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

GBCGIJAYTBMFHI-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID10110361

0 references

EC number

629-355-5

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.157.543

retrieved

27 December 2018

title

3-Mercapto-3-methyl-1-butanol (English)

quotation

CAS no.: 34300-94-2 (English)

ECHA Substance Infocard ID

100.157.543

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.157.543

retrieved

27 December 2018

title

3-Mercapto-3-methyl-1-butanol (English)

quotation

CAS no.: 34300-94-2 (English)

FL number

12.137

1 reference

quotation

CAS no.: 34300-94-2 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

12.137

Human Metabolome Database ID

HMDB0036149

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

GBCGIJAYTBMFHI-UHFFFAOYSA-N

UNII

1RF3LN9685

2 references

stated in

Global Substance Registration System

UNII

1RF3LN9685

language of work or name

English

title

3-mercapto-3-methyl-1-butanol (English)

retrieved

14 October 2016

matched by identifier from

InChIKey

InChIKey

GBCGIJAYTBMFHI-UHFFFAOYSA-N

Freebase ID

/m/03d2r1n

0 references

JECFA database ID

2645

0 references

JECFA number

544

1 reference

stated in

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

retrieved

13 May 2021

Microsoft Academic ID

2781266100

0 references

 

Sitelinks

Wikipedia(10 entries)

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• arwiki 3-ميركابتو 3-ميثيل بوتان -1-أول
• azbwiki ۳-مرکپتو-۳-متیل بوتان-۱-ال
• enwiki 3-Mercapto-3-methylbutan-1-ol
• fawiki ۳-مرکپتو-۳-متیل بوتان-۱-ال
• frwiki 3-Mercapto-3-méthylbutan-1-ol
• itwiki 3-mercapto-3-metilbutan-1-olo
• nlwiki 3-mercapto-3-methylbutaan-1-ol
• shwiki 3-Merkapto-3-metilbutan-1-ol
• srwiki 3-Merkapto-3-metilbutan-1-ol
• zhwiki 3-甲基-3-巯基-1-丁醇

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(0 entries)

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