DIOCTYL ADIPATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H42O4
Molecular Weight	370.5665
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC

InChI

InChIKey=NEHDRDVHPTWWFG-UHFFFAOYSA-N

InChI=1S/C22H42O4/c1-3-5-7-9-11-15-19-25-21(23)17-13-14-18-22(24)26-20-16-12-10-8-6-4-2/h3-20H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C22H42O4
Molecular Weight	370.5665
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
[Contents of phthalate in polyvinyl chloride toys].	2001 Feb	11383157
Secondary metabolites from a Streptomyces strain isolated from Livingston Island, Antarctica.	2001 Jan-Feb	11302198
Eleven phthalate esters and di(2-ethylhexyl) adipate in one-week duplicate diet samples obtained from hospitals and their estimated daily intake.	2001 May	11358187
Supercritical fluid extraction of potential migrants from paper and board intended for use as food packaging materials.	2002 Nov 15	12463369
Dehydroepiandrosterone 7-hydroxylase CYP7B: predominant expression in primate hippocampus and reduced expression in Alzheimer's disease.	2003	14521990
Estimated daily intake of plasticizers in 1-week duplicate diet samples following regulation of DEHP-containing PVC gloves in Japan.	2003 Apr	12775472
Direct analysis of plasticizers in aqueous samples by atmospheric pressure chemical ionization-tandem mass spectrometry (APCI-MS-MS).	2003 Jul-Aug	12908945
Identification and quantification of n-octyl esters of alkanoic and hexanedioic acids and phthalates as urban wastewater markers in biota and sediments from estuarine areas.	2004 Aug 13	15387189
Steroidogenesis in fetal male rats is reduced by DEHP and DINP, but endocrine effects of DEHP are not modulated by DEHA in fetal, prepubertal and adult male rats.	2004 Jan-Feb	15013064
DHEA and DHEA sulfate differentially regulate neural androgen receptor and its transcriptional activity.	2004 Jul 26	15249140
Early testicular effects in rats perinatally exposed to DEHP in combination with DEHA--apoptosis assessment and immunohistochemical studies.	2005 Mar-Apr	15749266
Antiandrogenic effects in male rats perinatally exposed to a mixture of di(2-ethylhexyl) phthalate and di(2-ethylhexyl) adipate.	2005 Mar-Apr	15749265
Dietary exposure to chemical migrants from food contact materials: a probabilistic approach.	2005 Oct	16236636
Amodiaquine polymeric membrane electrode.	2006 Apr 11	16303276
Plasticizers in Brazilian food-packaging materials acquired on the retail market.	2006 Jan	16393819
Considerations on ultra-trace analysis of phthalates in drinking water.	2006 Jul	16797669
Metabolites from the biodegradation of di-ester plasticizers by Rhodococcus rhodochrous.	2006 Jul 31	16316677
Fungal colonization of soil-buried plasticized polyvinyl chloride (pPVC) and the impact of incorporated biocides.	2006 Jun	16735736
Extractables/leachables from plastic tubing used in product manufacturing.	2006 Jun 6	16563675
Toxicity of di(2-ethylhexyl)phthalate (DEHP) and di(2-ethylhexyl)adipate (DEHA) under conditions of renal dysfunction induced with folic acid in rats: enhancement of male reproductive toxicity of DEHP is associated with an increase of the mono-derivative.	2006 Oct	16952438
Trace phthalate and adipate esters contaminated in packaged food.	2007 Jun-Jul	17562465
The debittering of navel orange juice using polymeric films.	2007 May	17995766
Atrazine-induced aromatase expression is SF-1 dependent: implications for endocrine disruption in wildlife and reproductive cancers in humans.	2007 May	17520059
Plasticizers and their degradation products in the process streams of a large urban physicochemical sewage treatment plant.	2008 Jan	17706266
Aqueous solubility and Daphnia magna chronic toxicity of di(2-ethylhexyl) adipate.	2008 Jun	18483781
Collaborative work on evaluation of ovarian toxicity. 9) Effects of 2- or 4-week repeated dose studies and fertility study of di(2-ethylhexyl)adipate (DEHA) in female rats.	2009	19265276
The effect of priming solutions and storage time on plasticizer migration in different PVC tubing types--implications for wet storage of ECMO systems.	2009 Dec	20092073
Comparison of solidification of floating drop and homogenous liquid-liquid microextractions for the extraction of two plasticizers from the water kept in PET-bottles.	2009 Sep	19746401
Application of artificial neural network for yield prediction of lipase-catalyzed synthesis of dioctyl adipate.	2009 Sep	19132557

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:28:56 GMT 2023` Edited by `admin` on `Fri Dec 15 19:28:56 GMT 2023`
Record UNII	2BD76YG9SI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIOCTYL ADIPATE

Systematic Name

English

ADIPIC ACID DIOCTYL ESTER

Systematic Name

English

FEMA NO. 4476

Code

English

DI-N-OCTYL ADIPATE

Common Name

English

HEXANEDIOIC ACID DIOCTYL ESTER

Systematic Name

English

DIOCTYL HEXANEDIOATE

Systematic Name

English

DICAPRYLYL ADIPATE

Systematic Name

English

DI-N-OCTYL ADIPATE [HSDB]

Common Name

English

NSC-16201

Code

English

Dioctyl adipate [WHO-DD]

Common Name

English

ADIPIC ACID, DIOCTYL ESTER

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

DIOCTYL ADIPATE