DIHEXYL PHTHALATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H30O4
Molecular Weight	334.4498
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC

InChI

InChIKey=KCXZNSGUUQJJTR-UHFFFAOYSA-N

InChI=1S/C20H30O4/c1-3-5-7-11-15-23-19(21)17-13-9-10-14-18(17)20(22)24-16-12-8-6-4-2/h9-10,13-14H,3-8,11-12,15-16H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C20H30O4
Molecular Weight	334.4498
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
Structure-dependent activity of phthalate esters and phthalate monoesters binding to human constitutive androstane receptor.	2015-06-15	25938866
Assessment of estrogenic potential of diethyl phthalate in female reproductive system involving both genomic and non-genomic actions.	2014-11	24994688
Phthalates efficiently bind to human peroxisome proliferator activated receptor and retinoid X receptor α, β, γ subtypes: an in silico approach.	2014-07	23843199
Genomic biomarkers of phthalate-induced male reproductive developmental toxicity: a targeted RT-PCR array approach for defining relative potency.	2012-02	22112501
Enzymatic hydrolysis of structurally diverse phthalic acid esters by porcine and bovine pancreatic cholesterol esterases.	2010-12	20822795
Removal of the endocrine disrupter butyl benzyl phthalate from the environment.	2010-06	20396882
Effects of in utero exposure to di-n-hexyl phthalate on the reproductive development of the male rat.	2009-12	19577633
Differential developmental toxicities of di-n-hexyl phthalate and dicyclohexyl phthalate administered orally to rats.	2009-08	19391110
Genetic and environmental pathways to complex diseases.	2009-05-05	19416532
Toxicity of seven phthalate esters to embryonic development of the abalone Haliotis diversicolor supertexta.	2009-04	19030987
Thermoreversible gelation of poly(vinylidene fluoride) in phthalates: the influence of aliphatic chain length of solvents.	2008-04-17	18366217
Effects of possible endocrine disruptors on MyD88-independent TLR4 signaling.	2008-03	18177342
Determination of phthalates and adipate in bottled water by headspace solid-phase microextraction and gas chromatography/mass spectrometry.	2008-01-18	18082753
[Acclimating, screening of dominant bacteria for degrading phthalic acid esters and study on its degradation].	2007-11	18303624
Enhanced degradation and toxicity reduction of dihexyl phthalate by Fusarium oxysporum f. sp. pisi cutinase.	2007-01	17184338
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006-11	16497524
Effects of possible endocrine disrupting chemicals on bacterial component-induced activation of NF-kappaB.	2006-10	17015962
[Determination of phthalic acid esters in textiles by solid phase extraction-gas chromatography].	2006-09	17165549
Primary and secondary relaxations in bis-5-hydroxypentylphthalate revisited.	2005-11-22	16351281
The toxic effect of phthalate esters on immune responses of giant freshwater prawn (Macrobrachium rosenbergii) via oral treatment.	2005-08-30	15993956
Differential effects of phthalate esters on transcriptional activities via human estrogen receptors alpha and beta, and androgen receptor.	2005-06-01	15840436
Alkyl phenols and diethylhexyl phthalate in tissues of sheep grazing pastures fertilized with sewage sludge or inorganic fertilizer.	2005-04	15811823
Unequivocal estrogen receptor-binding affinity of phthalate esters featured with ring hydroxylation and proper alkyl chain size.	2004-11-01	15464722
Suppression by phthalates of the calcium signaling of human nicotinic acetylcholine receptors in human neuroblastoma SH-SY5Y cells.	2004-08-05	15212808
Biodegradation of phthalate esters by two bacteria strains.	2004-04	15006506
Effects and toxicity of phthalate esters to hemocytes of giant freshwater prawn, Macrobrachium rosenbergii.	2003-06-19	12763673
NTP-CERHR Monograph on the Potential Human Reproductive and Developmental Effects of Di-n-Hexyl Phthalate (DnHP).	2003-05	15995729
Occurrence and microbial degradation of phthalate esters in Taiwan river sediments.	2002-12	12489726
NTP Center for the Evaluation of Risks to Human Reproduction: phthalates expert panel report on the reproductive and developmental toxicity of di-n-hexyl phthalate.	2002-10-31	12406497
An assessment of the toxicity of phthalate esters to freshwater benthos. 2. Sediment exposures.	2001-08	11491566
An assessment of the toxicity of phthalate esters to freshwater benthos. 1. Aqueous exposures.	2001-08	11491565
Effects on male rats of di-(2-ethylhexyl) phthalate and di-n-hexylphthalate administered alone or in combination.	2001-04-08	11312035

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:17:36 GMT 2025` Edited by `admin` on `Mon Mar 31 19:17:36 GMT 2025`
Record UNII	42MAH1QFG5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-4817

Preferred Name

English

DIHEXYL PHTHALATE

Systematic Name

English

1,2-BENZENEDICARBOXYLIC ACID, DIHEXYL ESTER

Common Name

English

DI-N-HEXYL PHTHALATE

Common Name

English

DIHEXYL BENZENE-1,2-DICARBOXYLATE

Systematic Name

English

DIHEXYL PHTHALATE [HSDB]

Common Name

English

Code System Code Type Description

HSDB

4490