Dipropyl phthalate
Product Information
Molecular Formula
C14H18O4
Molecular Weight
250.29
Description
Plasticizer.
Synonyms
dipropyl benzene-1,2-dicarboxylate
IUPAC Name
dipropyl benzene-1,2-dicarboxylate
SMILES
CCCOC(=O)C1=CC=CC=C1C(=O)OCCC
InChI
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
InChI Key
MQHNKCZKNAJROC-UHFFFAOYSA-N
Boiling Point
317.5 °C (lit.)
Flash Point
228.2 °F
Purity
95 %
Density
1.078 g/mL at 25°C(lit.)
Solubility
Soluble in chloroform, methanol
Appearance
Clear colorless liquid
Application
Used to make plasticizers and plastics and for laboratory applications.
Refractive Index
n20/D 1.497 (lit.)
LogP
2.82020
Vapor Pressure
0.000132 [mmHg]
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
H361:
Suspected of damaging fertility or the unborn child.
H411:
Toxic to aquatic life with long-lasting effects.
Causes skin irritation.
H319:
Causes serious eye irritation.
H361:
Suspected of damaging fertility or the unborn child.
H411:
Toxic to aquatic life with long-lasting effects.
Precautionary Statement
P201, P202, P273, P281, P308+P313, P391, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
4
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
8
Exact Mass
250.12050905 g/mol
Monoisotopic Mass
250.12050905 g/mol
Topological Polar Surface Area
52.6Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
247
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114146695-A | Preparation method of phthalate magnetic molecularly imprinted polymer extraction material | 2021-12-17 |
| CN-114181922-A | Recombinant esterase, gene, recombinant bacterium and application of recombinant esterase to degradation of phthalate | 2021-12-10 |
| CN-113929572-A | Method for synthesizing triethylene glycol dipropyl ester and application thereof | 2021-11-11 |
| CN-113896863-A | Epoxy resin glass high polymer material, three-component epoxy solution, preparation method and application | 2021-11-09 |
| CN-114094102-A | Secondary battery | 2021-11-03 |
| CN-113975962-A | Amino acid chelate deodorant and preparation method thereof | 2021-11-02 |
| CN-113975981-A | Poly (4-methyl-1-pentene)/polysulfone blended hollow fiber membrane, preparation method and application in artificial lung | 2021-09-07 |
| CN-113680337-A | Preparation method of carbamido/long-chain alkyl dual-functionalized silica gel stationary phase | 2021-08-24 |
| CN-113527233-A | Method for continuously producing succinic anhydride | 2021-08-18 |
| CN-113651783-A | Method for producing maleic anhydride and succinic anhydride in switching mode | 2021-08-18 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 28927721 | 2018-02-01 | Agonistic effects of diverse xenobiotics on the constitutive androstane receptor as detected in a recombinant yeast-cell assay | Toxicology in vitro : an international journal published in association with BIBRA |
| 27432241 | 2016-01-01 | Cytochrome P450-inhibitory activity of parabens and phthalates used in consumer products | The Journal of toxicological sciences |
| 25938866 | 2015-06-15 | Structure-dependent activity of phthalate esters and phthalate monoesters binding to human constitutive androstane receptor | Chemical research in toxicology |
| 23843199 | 2014-07-01 | Phthalates efficiently bind to human peroxisome proliferator activated receptor and retinoid X receptor α, β, γ subtypes: an in silico approach | Journal of applied toxicology : JAT |
| 22398195 | 2012-07-01 | Endocrine disruptors and asthma-associated chemicals in consumer products | Environmental health perspectives |
| 22148634 | 2012-01-01 | Easy synthesis of surface-tunable carbon-encapsulated magnetic nanoparticles: adsorbents for selective isolation and preconcentration of organic pollutants | ACS applied materials & interfaces |
| 21740974 | 2011-09-01 | Differential immune responses of the green neon shrimp (Neocaridina denticulate) to dipropyl phthalate | Fish & shellfish immunology |
| 21621291 | 2011-07-01 | Comparison of nonideal sorption formulations in modeling the transport of phthalate esters through packed soil columns | Journal of contaminant hydrology |
| 20652869 | 2011-01-01 | Developmental toxic potential of di-n-propyl phthalate administered orally to rats | Journal of applied toxicology : JAT |
| 20822795 | 2010-12-01 | Enzymatic hydrolysis of structurally diverse phthalic acid esters by porcine and bovine pancreatic cholesterol esterases | Chemosphere |
