DIHEPTYL PHTHALATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H34O4
Molecular Weight	362.503
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC

InChI

InChIKey=JQCXWCOOWVGKMT-UHFFFAOYSA-N

InChI=1S/C22H34O4/c1-3-5-7-9-13-17-25-21(23)19-15-11-12-16-20(19)22(24)26-18-14-10-8-6-4-2/h11-12,15-16H,3-10,13-14,17-18H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C22H34O4
Molecular Weight	362.503
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
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
Twenty-six-week oral toxicity of diheptyl phthalate with special emphasis on its induction of liver proliferative lesions in male F344 rats.	2012	22687992
Di-(2-ethylhexyl) phthalate enhances skin sensitization to isocyanate haptens in mice.	2010-02-01	19840837
Chemical analysis and risk assessment of diethyl phthalate in alcoholic beverages with special regard to unrecorded alcohol.	2009-12-02	19956573
Induction of liver preneoplastic foci in F344 rats subjected to 28-day oral administration of diheptyl phthalate and its in vivo genotoxic potential.	2009-10-01	19643158
Removal of phthalate esters by alpha-cyclodextrin-linked chitosan bead.	2007-09	17070038
Hershberger assay for antiandrogenic effects of phthalates.	2007-08	17654256
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006-11	16497524
An assessment of the potential developmental and reproductive toxicity of di-isoheptyl phthalate in rodents.	2006-04	16249068
Removal of phthalate esters from aqueous solutions by chitosan bead.	2006	16423728
Migration of contaminants by gas phase transfer from carton board and corrugated board box secondary packaging into foods.	2005-08	16147433
Unequivocal estrogen receptor-binding affinity of phthalate esters featured with ring hydroxylation and proper alkyl chain size.	2004-11-01	15464722
High-performance liquid chromatographic method for the determination of di(2-ethylhexyl) phthalate in total parenteral nutrition and in plasma.	2001-05-05	11393717
[Contents of phthalate in polyvinyl chloride toys].	2001-02	11383157

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:33:28 GMT 2025` Edited by `admin` on `Mon Mar 31 19:33:28 GMT 2025`
Record UNII	IE05VO8P8P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,2-BENZENEDICARBOXYLIC ACID, DIHEPTYL ESTER

Preferred Name

English

DIHEPTYL PHTHALATE

Systematic Name

English

DIHEPTYL PHTHALATE [HSDB]

Common Name

English

DIHEPTYL BENZENE-1,2-DICARBOXYLATE

Systematic Name

English

PHTHALIC ACID, DIHEPTYL ESTER

Common Name

English

Code System Code Type Description

FDA UNII

IE05VO8P8P