hydroxydi(phenyl)acetic acid (Q411740)

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chemical compound

• diphenylglycolic acid
• alpha-phenylmandelic acid
• alpha-hydroxy-2,2-diphenylacetic acid
• 2-hydroxy-2,2-diphenylacetic acid
• alpha,alpha-diphenylglycolic acid
• alpha,alpha-diphenyl-alpha-hydroxyacetic acid
• alpha-hydroxy-alpha-phenylbenzeneacetic acid
• benzilic acid

edit

Language	Label	Description	Also known as
English	hydroxydi(phenyl)acetic acid	chemical compound	diphenylglycolic acid alpha-phenylmandelic acid alpha-hydroxy-2,2-diphenylacetic acid 2-hydroxy-2,2-diphenylacetic acid alpha,alpha-diphenylglycolic acid alpha,alpha-diphenyl-alpha-hydroxyacetic acid alpha-hydroxy-alpha-phenylbenzeneacetic acid benzilic acid

Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

chemical structure

Benzilic acid.svg
777 × 487; 3 KB

1 reference

imported from Wikimedia project

German Wikipedia

mass

228.079 dalton

1 reference

stated in

PubChem

PubChem CID

6463

language of work or name

English

title

BENZILIC ACID (English)

retrieved

19 October 2016

chemical formula

C₁₄H₁₂O₃

1 reference

stated in

PubChem

PubChem CID

6463

language of work or name

English

title

BENZILIC ACID (English)

retrieved

19 November 2016

canonical SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)O

1 reference

stated in

PubChem

PubChem CID

6463

language of work or name

English

title

BENZILIC ACID (English)

retrieved

19 November 2016

density

1.08 gram per cubic centimetre

temperature

20 degree Celsius

phase of matter

solid

1 reference

Römpp online ID

RD-02-00793

melting point

151±1 degree Celsius

1 reference

Römpp online ID

RD-02-00793

150.0 degree Celsius

1 reference

stated in

Jean-Claude Bradley Open Melting Point Dataset

boiling point

180 degree Celsius

under pressure

17.3 hectopascal

1 reference

Römpp online ID

RD-02-00793

solubility

1.4 gram per litre

temperature

25 degree Celsius

solvent

water

1 reference

Römpp online ID

RD-02-00793

safety classification and labelling

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

NFPA Health

2

NFPA Fire

1

NFPA Instability

0

NFPA Special

no value

1 reference

imported from Wikimedia project

English Wikipedia

median lethal dose (LD50)

2,000 milligram per kilogram

route of administration

oral administration

applies to taxon

mouse

1 reference

Römpp online ID

RD-02-00793

has characteristic

bitterness

1 reference

stated in

BitterDB

Commons category

Benzilic acid

0 references

Identifiers

InChI

InChI=1S/C14H12O3/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,17H,(H,15,16)

1 reference

stated in

PubChem

PubChem CID

6463

language of work or name

English

title

BENZILIC ACID (English)

retrieved

19 November 2016

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

6463

language of work or name

English

title

BENZILIC ACID (English)

retrieved

19 November 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

76-93-7

2 references

stated in

Global Substance Registration System

UNII

8F6J993XXR

language of work or name

English

title

benzilic acid (English)

retrieved

19 November 2016

stated in

CAS Common Chemistry

retrieved

5 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=76-93-7

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

ChemSpider ID

6220

1 reference

stated in

ChemSpider

ChemSpider ID

6220

language of work or name

English

title

Benzilic acid (English)

retrieved

19 November 2016

PubChem CID

6463

2 references

stated in

PubChem

PubChem CID

6463

language of work or name

English

title

BENZILIC ACID (English)

retrieved

19 November 2016

matched by identifier from

InChIKey

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

Reaxys registry number

521402

1 reference

stated in

ChEBI

ChEBI ID

39414

language of work or name

English

title

benzilic acid (English)

retrieved

19 October 2016

Gmelin number

281752

0 references

ChEBI ID

39414

mapping relation type

exact match

2 references

stated in

ChEMBL

ChEMBL ID

CHEMBL578171

language of work or name

English

title

BENZYLIC ACID (English)

retrieved

19 November 2016

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C14H12O3/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,17H,(H,15,16)

ChEMBL ID

CHEMBL578171

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL578171

language of work or name

English

title

BENZYLIC ACID (English)

retrieved

19 November 2016

SureChEMBL ID

SCHEMBL7066

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

UniChem compound ID

459524

1 reference

stated in

UniChem

NMRShiftDB structure ID

10005730

1 reference

matched by identifier from

InChIKey

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

ZVG number

37330

0 references

HSDB ID

7709

1 reference

stated in

Hazardous Substances Data Bank

HSDB ID

7709

publication date

28 October 2019

title

BENZILIC ACID (English)

retrieved

10 May 2021

DSSTox substance ID

DTXSID0058805

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID9047837

0 references

NSC number

2830

0 references

EC number

200-993-2

1 reference

stated in

Global Substance Registration System

UNII

8F6J993XXR

language of work or name

English

title

benzilic acid (English)

retrieved

19 November 2016

ECHA Substance Infocard ID

100.000.904

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.000.904

retrieved

27 December 2018

title

Benzilic acid (English)

quotation

CAS no.: 76-93-7 (English)

CosIng number

54846

1 reference

stated in

CosIng database

CosIng number

54846

retrieved

28 December 2019

title

BENZILIC ACID (English)

quotation

CAS no.: 76-93-7 (English)

RxNorm ID

1430394

1 reference

stated in

Global Substance Registration System

UNII

8F6J993XXR

language of work or name

English

title

benzilic acid (English)

retrieved

19 November 2016

Human Metabolome Database ID

HMDB0248991

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

UNII

8F6J993XXR

2 references

stated in

Global Substance Registration System

UNII

8F6J993XXR

language of work or name

English

title

benzilic acid (English)

retrieved

19 November 2016

matched by identifier from

InChIKey

InChIKey

UKXSKSHDVLQNKG-UHFFFAOYSA-N

PDB ligand ID

0UT

0 references

Freebase ID

/m/02qkd24

1 reference

stated in

Freebase Data Dumps

publication date

28 October 2013

Microsoft Academic ID

2777490344

0 references

PDB structure ID

4HNC

1 reference

stated in

Protein Data Bank

PDB structure ID

4HNC

language of work or name

English

title

4HNC (English)

retrieved

19 October 2016

 

Sitelinks

Wikipedia(16 entries)

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• arwiki حمض البنزيليك
• azbwiki بنزیلیک اسید
• dewiki Benzilsäure
• enwiki Benzilic acid
• eswiki Ácido bencílico
• euwiki Azido bentziliko
• fawiki بنزیلیک اسید
• fiwiki Bentsiilihappo
• hiwiki बेन्जिलिक अम्ल
• jawiki ベンジル酸
• rowiki Acid benzilic
• ruwiki Бензиловая кислота
• shwiki Benzilinska kiselina
• srwiki Benzilinska kiselina
• tawiki பென்சிலிக் அமிலம்
• zhwiki 二苯乙醇酸

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:Benzilic acid

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