DI-N-PROPYLPHTHALATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H18O4
Molecular Weight	250.2903
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCOC(=O)C1=CC=CC=C1C(=O)OCCC

InChI

InChIKey=MQHNKCZKNAJROC-UHFFFAOYSA-N

InChI=1S/C14H18O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C14H18O4
Molecular Weight	250.2903
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
Simple and rapid analysis of endocrine disruptors in liquid medicines and intravenous injection solutions by automated in-tube solid-phase microextraction/high performance liquid chromatography.	2003 Jul 14	14565551
Biodegradation of phthalate esters by two bacteria strains.	2004 Apr	15006506
Unequivocal estrogen receptor-binding affinity of phthalate esters featured with ring hydroxylation and proper alkyl chain size.	2004 Nov 1	15464722
Effects of phthalate esters on the sensitization phase of contact hypersensitivity induced by fluorescein isothiocyanate.	2006 Nov	17083357
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006 Nov	16497524
Effects of possible endocrine disrupting chemicals on bacterial component-induced activation of NF-kappaB.	2006 Oct	17015962
[Determination of phthalic acid esters in textiles by solid phase extraction-gas chromatography].	2006 Sep	17165549
Enzymatic hydrolysis of structurally diverse phthalic acid esters by porcine and bovine pancreatic cholesterol esterases.	2010 Dec	20822795
Determination of phthalates in fruit jellies by dispersive SPE coupled with HPLC-MS.	2010 Feb	19998379
Removal of the endocrine disrupter butyl benzyl phthalate from the environment.	2010 Jun	20396882
Phthalate esters reveal skin-sensitizing activity of phenethyl isothiocyanate in mice.	2010 Jun	20371259
Preparation of a chitosan-coated C(18)-functionalized magnetite nanoparticle sorbent for extraction of phthalate ester compounds from environmental water samples.	2010 May	20229007
Phthalates efficiently bind to human peroxisome proliferator activated receptor and retinoid X receptor α, β, γ subtypes: an in silico approach.	2014 Jul	23843199
Structure-dependent activity of phthalate esters and phthalate monoesters binding to human constitutive androstane receptor.	2015 Jun 15	25938866

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:33:02 GMT 2023` Edited by `admin` on `Fri Dec 15 19:33:02 GMT 2023`
Record UNII	8USP5Y77SS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DI-N-PROPYLPHTHALATE

Common Name

English

1,2-BENZENEDICARBOXYLIC ACID DIPROPYL ESTER

Systematic Name

English

NSC-15314

Code

English

DIPROPYL PHTHALATE

Systematic Name

English

DIPROPYL BENZENE-1,2-DICARBOXYLATE

Systematic Name

English

DIPROPYL ESTER1,2-BENZENEDICARBOXYLIC ACID

Systematic Name

English

1,2-BENZENEDICARBOXYLIC ACID, DIPROPYL ESTER

Common Name

English

Code System Code Type Description

CAS

131-16-8