(±)-sec-butyl acetate (Q421143)

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pair of enantiomers

• 2-butyl acetate
• s-butyl acetate
• sec-butyl ester of acetic acid
• 1-methylpropyl acetate

edit

Language	Label	Description	Also known as
English	(±)-sec-butyl acetate	pair of enantiomers	2-butyl acetate s-butyl acetate sec-butyl ester of acetic acid 1-methylpropyl acetate

Statements

instance of

group of stereoisomers

0 references

subclass of

acetate ester

0 references

butyl ester

0 references

biogenic acyclic ester

1 reference

inferred from

biogenic acyclic ester

chemical structure

Sec-Butylacetat.svg
235 × 95; 18 KB

criterion used

structure representation with labelled terminal carbon atoms

1 reference

imported from Wikimedia project

German Wikipedia

Sec-butyl acetate.svg
1,058 × 500; 847 bytes

criterion used

structure representation with unlabelled terminal carbon atoms

0 references

mass

116.084 dalton

1 reference

stated in

PubChem

PubChem CID

7758

language of work or name

English

title

SEC-BUTYL ACETATE (English)

retrieved

14 October 2016

associated hazard

sec-Butyl acetate exposure

0 references

has effect

sec-Butyl acetate exposure

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

chemical formula

C₆H₁₂O₂

1 reference

stated in

PubChem

PubChem CID

7758

language of work or name

English

title

SEC-BUTYL ACETATE (English)

retrieved

20 November 2016

canonical SMILES

CCC(C)OC(=O)C

1 reference

stated in

PubChem

PubChem CID

7758

language of work or name

English

title

SEC-BUTYL ACETATE (English)

retrieved

20 November 2016

ionization energy

9.91±0.01 electronvolt

series ordinal

1

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

9.90 electronvolt

series ordinal

1

1 reference

stated in

Basic laboratory and industrial chemicals: A CRC quick reference handbook

density

0.86±0.01 gram per cubic centimetre

temperature

20±1 degree Celsius

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

melting point

−100±1 degree Fahrenheit

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

−99.0 degree Celsius

1 reference

stated in

Jean-Claude Bradley Open Melting Point Dataset

−98.9 degree Celsius

1 reference

stated in

Basic laboratory and industrial chemicals: A CRC quick reference handbook

boiling point

234±1 degree Fahrenheit

under pressure

760±1 torr

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

112 degree Celsius

under pressure

101.325 kilopascal

1 reference

stated in

Basic laboratory and industrial chemicals: A CRC quick reference handbook

vapor pressure

10±1 millimetre of mercury

temperature

68±1 degree Fahrenheit

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

solubility

0.8±0.1 gram per 100 gram of solvent

temperature

68±1 degree Fahrenheit

solvent

water

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

flash point

62±1 degree Fahrenheit

determination method or standard

Pensky–Martens closed-cup test

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

lower flammable limit

1.7±0.1 volume percent

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

upper flammable limit

9.8±0.1 volume percent

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

NIOSH Pocket Guide ID

0073

0 references

time-weighted average exposure limit

950±1 milligram per cubic metre

applies to jurisdiction

United States of America

duration

10±1 hour

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

immediately dangerous to life or health

8,075±1 milligram per cubic metre

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

found in taxon

Sauromatum venosum

1 reference

stated in

Dimethyl oligosulphides, major volatiles released from Sauromatum guttatum and Phallus impudicus

tomato

1 reference

stated in

Effect of autochthonous lactic acid bacteria starters on health-promoting and sensory properties of tomato juices

Zingiber officinale

1 reference

stated in

Determination of volatile components in ginger using gas chromatography-mass spectrometry with resolution improved by data processing techniques

has characteristic

Class IB flammable liquid

1 reference

reference URL

http://www.cdc.gov/niosh/npg/npgd0073.html

Commons category

Sec-Butyl acetate

0 references

Identifiers

InChI

InChI=1S/C6H12O2/c1-4-5(2)8-6(3)7/h5H,4H2,1-3H3

1 reference

stated in

PubChem

PubChem CID

7758

language of work or name

English

title

SEC-BUTYL ACETATE (English)

retrieved

20 November 2016

InChIKey

DCKVNWZUADLDEH-UHFFFAOYSA-N

1 reference

stated in

PubChem

PubChem CID

7758

language of work or name

English

title

SEC-BUTYL ACETATE (English)

retrieved

20 November 2016

CAS Registry Number

105-46-4

2 references

stated in

Global Substance Registration System

UNII

UVH2QII6CG

language of work or name

English

title

sec-butyl acetate (English)

retrieved

20 November 2016

InChIKey

DCKVNWZUADLDEH-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=105-46-4

ChemSpider ID

7472

1 reference

stated in

ChemSpider

ChemSpider ID

7472

language of work or name

English

title

SEC-BUTYLACETATE (English)

retrieved

20 November 2016

PubChem CID

7758

1 reference

stated in

PubChem

PubChem CID

7758

language of work or name

English

title

SEC-BUTYL ACETATE (English)

retrieved

20 November 2016

SureChEMBL ID

SCHEMBL26183

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

DCKVNWZUADLDEH-UHFFFAOYSA-N

UniChem compound ID

23842205

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP001202

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP001203

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP001304

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP001524

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP005908

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP005971

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP005831

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008532

0 references

SPLASH

splash10-0006-9000000000-d07142c84c139fa949c9

0 references

splash10-0006-9000000000-6b5b933f04a6138fca4a

0 references

splash10-0006-9000000000-fe9fbf0a38e9d2dfce0a

0 references

splash10-0006-9000000000-65bca2aad8c90318a0c6

0 references

splash10-0006-9000000000-b7b62aa4ddd87046c6fe

0 references

splash10-0079-9100000000-de446c8bd7c2d2bc388d

0 references

splash10-0006-9000000000-e1a3e83cd1aa51bf49ee

0 references

ICSC ID

0840

0 references

CAMEO Chemicals ID

8346

0 references

RTECS number

AF7380000

0 references

ZVG number

37250

0 references

HSDB ID

673

1 reference

stated in

Hazardous Substances Data Bank

HSDB ID

673

publication date

28 October 2019

title

SEC-BUTYL ACETATE (English)

retrieved

10 May 2021

DSSTox substance ID

DTXSID0047612

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

DCKVNWZUADLDEH-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID8027612

0 references

NSC number

8034

0 references

EC number

203-300-1

1 reference

stated in

Global Substance Registration System

UNII

UVH2QII6CG

language of work or name

English

title

sec-butyl acetate (English)

retrieved

20 November 2016

ECHA Substance Infocard ID

100.003.001

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.003.001

retrieved

27 December 2018

title

sec-butyl acetate (English)

quotation

CAS no.: 105-46-4 (English)

OSHA Occupational Chemical Database ID

33

0 references

FL number

09.323

1 reference

quotation

CAS no.: 105-46-4 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

09.323

CosIng number

90066

1 reference

stated in

CosIng database

CosIng number

90066

retrieved

28 December 2019

title

SEC-BUTYL ACETATE (English)

quotation

CAS no.: 105-46-4 (English)

Human Metabolome Database ID

HMDB0258198

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

DCKVNWZUADLDEH-UHFFFAOYSA-N

KNApSAcK ID

C00059030

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

DCKVNWZUADLDEH-UHFFFAOYSA-N

UNII

UVH2QII6CG

2 references

stated in

Global Substance Registration System

UNII

UVH2QII6CG

language of work or name

English

title

sec-butyl acetate (English)

retrieved

20 November 2016

matched by identifier from

InChIKey

InChIKey

DCKVNWZUADLDEH-UHFFFAOYSA-N

Freebase ID

/m/09zb9p

1 reference

stated in

Freebase Data Dumps

publication date

28 October 2013

HCIS ID

708

0 references

Microsoft Academic ID

2775847632

0 references

 

Sitelinks

Wikipedia(12 entries)

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• azbwiki Sec-بوتیل استات
• dewiki Essigsäure-sec-butylester
• enwiki Sec-Butyl acetate
• eowiki 2-Butila acetato
• fawiki Sec-بوتیل استات
• fiwiki Sek-butyyliasetaatti
• frwiki Acétate de sec-butyle
• jawiki 酢酸sec-ブチル
• nlwiki Sec-butylacetaat
• shwiki Sec-Butil acetat
• srwiki Sec-Butil acetat
• zhwiki 乙酸仲丁酯

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:Sec-Butyl acetate

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