2,2-bis(hydroxymethyl)butanoic acid (Q27258575)

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chemical compound

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Language	Label	Description	Also known as
English	2,2-bis(hydroxymethyl)butanoic acid	chemical compound

Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

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chemical structure

2,2-Bis(hydroxymethyl)butanoic acid.svg
330 × 290; 7 KB

0 references

mass

148.074±0 dalton

1 reference

stated in

PubChem

PubChem CID

3301396

language of work or name

English

title

10097-02-6 (English)

retrieved

14 October 2016

chemical formula

C₆H₁₂O₄

1 reference

stated in

PubChem

PubChem CID

3301396

language of work or name

English

title

10097-02-6 (English)

retrieved

14 October 2016

canonical SMILES

CCC(CO)(CO)C(=O)O

1 reference

stated in

PubChem

PubChem CID

3301396

language of work or name

English

title

10097-02-6 (English)

retrieved

14 October 2016

Identifiers

InChI

InChI=1S/C6H12O4/c1-2-6(3-7,4-8)5(9)10/h7-8H,2-4H2,1H3,(H,9,10)

1 reference

stated in

PubChem

PubChem CID

3301396

language of work or name

English

title

10097-02-6 (English)

retrieved

14 October 2016

InChIKey

JVYDLYGCSIHCMR-UHFFFAOYSA-N

1 reference

stated in

PubChem

PubChem CID

3301396

language of work or name

English

title

10097-02-6 (English)

retrieved

14 October 2016

CAS Registry Number

10097-02-6

2 references

stated in

Global Substance Registration System

UNII

42UJ0Z625V

language of work or name

English

title

2,2-bis(hydroxymethyl)butanoic acid (English)

retrieved

14 October 2016

InChIKey

JVYDLYGCSIHCMR-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

8 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=10097-02-6

ChemSpider ID

2549721

1 reference

stated in

ChemSpider

ChemSpider ID

2549721

language of work or name

English

title

2,2-Bis(hydroxymethyl)butyric acid (English)

retrieved

14 October 2016

PubChem CID

3301396

1 reference

stated in

PubChem

PubChem CID

3301396

language of work or name

English

title

10097-02-6 (English)

retrieved

14 October 2016

SureChEMBL ID

SCHEMBL39652

1 reference

based on heuristic

inferred from InChIKey

UniChem compound ID

23846139

1 reference

stated in

UniChem

ZVG number

902610

0 references

DSSTox substance ID

DTXSID8064939

1 reference

stated in

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

DSSTOX compound identifier

DTXCID1032567

0 references

EC number

424-090-1

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.102.262

retrieved

27 December 2018

title

2,2-bis(hydroxymethyl)butanoic acid (English)

quotation

CAS no.: 10097-02-6 (English)

ECHA Substance Infocard ID

100.102.262

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.102.262

retrieved

27 December 2018

title

2,2-bis(hydroxymethyl)butanoic acid (English)

quotation

CAS no.: 10097-02-6 (English)

CosIng number

97152

1 reference

stated in

CosIng database

CosIng number

97152

retrieved

28 December 2019

title

DIMETHYLOLBUTYRIC ACID (English)

quotation

CAS no.: 10097-02-6 (English)

UNII

42UJ0Z625V

1 reference

stated in

Global Substance Registration System

UNII

42UJ0Z625V

language of work or name

English

title

2,2-bis(hydroxymethyl)butanoic acid (English)

retrieved

14 October 2016

HCIS ID

590

0 references

 

Sitelinks

Wikipedia(1 entry)

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• zhwiki 2,2-二羟甲基丁酸

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Wikinews(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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