dibutyl phthalate (Q415612)

Gene Ontology release 2019-11-16

has use

plasticizer

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chemical structure

Dibutylphthalate Structural Formulae V.1.svg
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German Wikipedia

Dibutyl phthalate.svg
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mass

278.152 dalton

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dibutyl phthalate (English)

dibutyl phthalate exposure

19 October 2016

has effect

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chemical formula

C₁₆H₂₂O₄

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dibutyl phthalate (English)

19 November 2016

canonical SMILES

CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC

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dibutyl phthalate (English)

19 November 2016

density

1.05±0.01 gram per cubic centimetre

20±1 degree Celsius

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melting point

−31±1 degree Fahrenheit

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−35 degree Celsius

2 references

Jean-Claude Bradley Open Melting Point Dataset

Basic laboratory and industrial chemicals: A CRC quick reference handbook

boiling point

644±1 degree Fahrenheit

under pressure

760±1 torr

1 reference

340 degree Celsius

under pressure

101.325 kilopascal

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

vapor pressure

0.00007±0.00001 millimetre of mercury

68±1 degree Fahrenheit

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solubility

0.001±0.001 gram per 100 gram of solvent

77±1 degree Fahrenheit

solvent

water

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Pensky–Martens closed-cup test

flash point

315±1 degree Fahrenheit

determination method

1 reference

lower flammable limit

0.5±0.1 volume percent

456±1 degree Fahrenheit

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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

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time-weighted average exposure limit

English Wikipedia

NIOSH Pocket Guide ID

0187

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5±1 milligram per cubic metre

applies to jurisdiction

United States of America

duration

10±1 hour

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immediately dangerous to life or health

4,000±1,000 milligram per cubic metre

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found in taxon

Liquidambar styraciflua

1 reference

Constituents of Essential Oil from Leaves of Liquidambar styraciflua L.1

Launaea resedifolia

1 reference

Chemical composition and antibacterial activity of the essential oils from Launaea resedifolia L

Allium ampeloprasum

1 reference

Volatile Compounds in Leek and Asafoetida

Euphorbia hirta

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Chemical constituents from Euphorbia hirta

Chemical constituents from Euphorbia lunulata

liquorice

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Volatile flavor components of licorice

Gymnodinium nagasakiense

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Cell-destroying sesquiterpenoid from red tide of Gymnodinium nagasakiense

Lythrum salicaria

1 reference

Characterization of the polyphenolic composition of purple loosestrife (Lythrum salicaria).

Phytolacca acinosa

1 reference

Triterpenoids from Phytolacca acinosa

Saussurea involucrata

1 reference

Components of the Essential Oil ofSaussurea involucrata(Kar. et Kir.) ex Maxim

Scutellaria amoena

1 reference

New flavonoid glycosides from Scutellaria amoena

Scutellaria baicalensis

1 reference

Essential oil of Scutellaria baicalensis G.

Rhododendron dauricum

1 reference

Chromatographic and electrophoretic methods for pharmaceutically active compounds in Rhododendron dauricum

Eleutherococcus sessiliflorus

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Lipids of the fruit ofAcanthopanax sessiliflorus

Balanites wilsoniana

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Steroids, phthalyl esters and hydrocarbons from Balanites wilsoniana stem bark

Bulbophyllum odoratissimum

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Chemical constituents of Bulbophyllum odoratissimum

Cichorium glandulosum

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Components of Cichorium glandulosum seeds

Cryptotaenia canadensis

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Phthalate esters of Cryptotaenia canadensis DC. var. japonica Makino (Umbelliferae)

Mimusops elengi

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Dibutyl phthalate, a secondary metabolite from Mimusops elengi

Aloe vera

1 reference

Components of the gel of Aloe vera (L.) burm. f.

Dendrobium longicornu

1 reference

Mono-aromatic constituents of Dendrobium longicornu

Acca sellowiana

1 reference

Compositional Analysis and Aroma Evaluation of Feijoa Essential Oils from New Zealand Grown Cultivars

Penicillium bilaiae

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Secondary metabolites of Penicillium bilaii strain PB-50

Streptomyces albidoflavus

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Dibutyl phthalate, the bioactive compound produced by Streptomyces albidoflavus 321.2.

Streptomyces filamentosus

1 reference

Roseosporol A, the first isolation of a novel sesquiterpenoid from Streptomyces roseosporus

Allium cepa

1 reference

Chemical compositions and antioxidant/anti-inflammatory activities of steam distillate from freeze-dried onion ( Allium cepa L.) sprout

Ceratophyllum demersum

1 reference

Chemical composition of essential oils of two submerged macrophytes,Ceratophyllum demersum L. andVallisneria spiralis L.

Capsicum annuum

1 reference

Influence of different drying technologies on the volatile components of chilli (<I>Capsicum annuum</I> L.) powder

Nicotiana tabacum

1 reference

Comparison of different extraction methods: steam distillation, simultaneous distillation and extraction and headspace co-distillation, used for the analysis of the volatile components in aged flue-cured tobacco leaves

Zingiber officinale

1 reference

Metabolic Profiles of Ginger, A Functional Food, and Its Representative Pungent Compounds in Rats by Ultraperformance Liquid Chromatography Coupled with Quadrupole Time-of-Flight Tandem Mass Spectrometry.

Osmanthus fragrans

1 reference

Headspace Analysis of Osmanthus fragrans Lour.

Karenia mikimotoi

1 reference

Cell-destroying sesquiterpenoid from red tide of Gymnodinium nagasakiense

Cichorium pumilum

1 reference

Components of Cichorium glandulosum seeds

Wurfbainia villosa

1 reference

The Essential Oil of Amomum villosum Lour.

physically interacts with

Transient receptor potential cation channel subfamily A member 1

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

6295

Class IIIB combustible liquid

17 August 2016

has characteristic

1 reference

subject has role

plasticizer

1 reference

Medical Subject Headings

MeSH descriptor ID

D003993

female reproductive toxicant

15 March 2018

start time

2 December 2005

1 reference

24 February 2020

https://oehha.ca.gov/chemicals/di-n-butyl-phthalate

male reproductive toxicant

start time

2 December 2005

1 reference

25 February 2020

https://oehha.ca.gov/chemicals/di-n-butyl-phthalate

developmental toxicant

start time

2 December 2005

1 reference

25 February 2020

https://oehha.ca.gov/chemicals/di-n-butyl-phthalate

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Dibutyl phthalate

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Identifiers

NL CR AUT ID

ph119427

subject named as

dibutylftalát

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InChI

InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3

1 reference

dibutyl phthalate (English)

DOIRQSBPFJWKBE-UHFFFAOYSA-N

19 November 2016

InChIKey

2 references

dibutyl phthalate (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

84-74-2

2 references

dibutyl phthalate (English)

DOIRQSBPFJWKBE-UHFFFAOYSA-N

19 November 2016

InChIKey

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=84-74-2

1 reference

Dibutyl phthalate (English)

19 October 2016

1 reference

dibutyl phthalate (English)

19 November 2016

Reaxys registry number

1914064

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dibutyl phthalate (English)

19 October 2016

Gmelin number

262569

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ChEBI ID

34687

mapping relation type

1 reference

DIBUTYL PHTHALATE (English)

19 November 2016

1 reference

MSBNK-Fac_Eng_Univ_Tokyo-JP001700

DIBUTYL PHTHALATE (English)

19 November 2016

1 reference

MassBank accession ID

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MSBNK-Fac_Eng_Univ_Tokyo-JP003306

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MSBNK-Fac_Eng_Univ_Tokyo-JP006128

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MSBNK-BGC_Munich-RP019901

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MSBNK-BGC_Munich-RP019902

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MSBNK-BGC_Munich-RP019903

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MSBNK-Fac_Eng_Univ_Tokyo-JP005814

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MSBNK-Fac_Eng_Univ_Tokyo-JP008514

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SPLASH

splash10-0002-0900000000-78eaf490a7fb4d87b419

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splash10-0002-0900000000-5c75cf8111466a2bd813

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splash10-0002-0900000000-a0747aefa385c43d47b1

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splash10-006t-1900000000-29635db4a2da5e62db7f

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splash10-00xs-5900000000-02c97dee9727d0badc2e

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splash10-014i-9200000000-2b0820b30884f0f997a5

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splash10-014i-9000000000-5d4f80a8a661596a7cc8

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splash10-014i-9000000000-f45a033b5a30528756de

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splash10-004i-0590000000-d7fd13586fba8d9bcbb8

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splash10-003r-0900000000-26a0280d411587ad0406

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splash10-003r-0900000000-01dec35be5d4cb24d183

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splash10-00b9-1900000000-0a9f876d83f5cdff62be

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splash10-004i-6900000000-88c2bba04cf08d8a94e7

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splash10-004i-9300000000-6e11d76c309a036870da

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splash10-004i-9000000000-24ad78f1c73dbed6290d

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splash10-004i-9000000000-2d5177b1586a4461b278

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splash10-004i-9000000000-4516fb7c10721dc8cedb

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splash10-0a6s-0490000000-bb10c8ff49d65e9fbcfd

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splash10-0002-1910000000-964b3411de1f914de4da

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splash10-0002-0910000000-97464fdc3b8040ec3d36

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splash10-052b-0960000000-7a12a722da333ebed5e0

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splash10-0002-5900000000-bb309d93583ab774d1f9

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splash10-0002-0900000000-19ad0b11756e1ca9188a

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splash10-0002-0900000000-c218819436377fba26c9

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splash10-0002-0930000000-3ffd578a63631650756a

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splash10-0002-0920000000-f84bcb5ebbad7fcd0a80

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splash10-0002-0900000000-0b26194ced4d64df6a2f

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splash10-0002-3900000000-ecab0016129a96c4ece7

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TI0875000

1 reference

English Wikipedia

ZVG number

21620

1 reference

Hazardous Substances Data Bank

1 reference

28 October 2019

DIBUTYL PHTHALATE (English)

10 May 2021

1 reference

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

DSSTOX compound identifier

0 references

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201-557-4

1 reference

dibutyl phthalate (English)

ECHA Substance Infocard ID

19 November 2016

100.001.416

1 reference

http://echa.europa.eu/de/information-on-chemicals/registered-substances

1 reference

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AICS Chemical ID (BEING DELETED)

1262

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ATC code

P03BX03

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Guide to Pharmacology Ligand ID

6295

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

6295

dibutyl phthalate (English)

19 November 2016

Dibutyl Phthalate

0 references

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1 reference

dibutyl phthalate (English)

19 November 2016

1 reference

6 July 2021

CAS no.: 84-74-2 (English)

Human Metabolome Database ID

Dibutylphthalate (English)

HMDB0033244

1 reference

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00053140

1 reference

based on heuristic

inferred from InChIKey

1 reference

dibutyl phthalate (English)

19 November 2016

0 references

1 reference

1 reference

Immune Epitope Database and Analysis Resource

dibutyl phthalate (English)

19 October 2016

1 reference

1 March 2022

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1 reference

12 December 2019

https://oehha.ca.gov/chemicals/di-n-butyl-phthalate

1 reference

28 October 2013

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1 reference

9 July 2020

Microsoft Academic ID

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1 reference

26 January 2022

https://docs.openalex.org/download-snapshot/snapshot-data-format

OSHA Occupational Chemical Database ID

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1 reference

4G5I (English)

inferred by common MeSH mappings on source and on Wikidata

19 October 2016

Store norske leksikon ID

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1 reference

UMLS 2023