Di(2-ethylhexyl) Fumarate

Inquiry

Molecular Formula:

C20H36O4

Molecular Weight:

340.5

CAS Number:

141-02-6

Catalog Number:

141-02-6

Product Information

Molecular Formula:

C20H36O4

Molecular Weight:

340.5

Description

Di(2-ethylhexyl) Fumarate is an extensively employed compound in the biomedical sphere renowned for its multifaceted properties. This plasticizer finds indispensable utility across diverse medical instruments, including catheters and blood bags. Its exceptional attribute lies in the impeccable biocompatibility rendering it apt for deployment in blood-contacting and tissue-interacting products.

Synonyms

Fumaric Acid Di(2-ethylhexyl) Ester||||Di(2-ethylhexyl) Fumarate||||Dioctyl Fumarate||||Fumaric Acid Dioctyl Ester

IUPAC Name

bis(2-ethylhexyl) (E)-but-2-enedioate

Canonical SMILES

CCCCC(CC)COC(=O)C=CC(=O)OCC(CC)CCCC

InChI

InChI=1S/C20H36O4/c1-5-9-11-17(7-3)15-23-19(21)13-14-20(22)24-16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16H2,1-4H3/b14-13+

InChI Key

ROPXFXOUUANXRR-BUHFOSPRSA-N

Boiling Point

185 °C/5 mmHg

Flash Point

190 °C

Purity

>98.0%(GC)

Density

0.94

Appearance

Colorless to Almost colorless clear liquid

Refractive Index

1.46

Vapor Pressure

0.000059 [mmHg]

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

XLogP3

6.5

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

340.26135963 g/mol

Monoisotopic Mass

340.26135963 g/mol

Topological Polar Surface Area

52.6Å²

Heavy Atom Count

Formal Charge

Complexity

329

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
RU-2754913-C1	Method for selective preparation of exo,exo- and endo,endo-di(2-ethylhexyl)norbornene-2,3-dicarboxylates from c5 fraction of liquid pyrolysis products	2020-12-08
WO-2022044837-A1	Liquid crystal display device	2020-08-28
WO-2022019121-A1	Polarizing plate, method for producing polarizing plate, and display device	2020-07-21
WO-2021256270-A1	Adhesive agent, laminate, method for manufacturing laminate, and packaging material	2020-06-18
JP-2021195397-A	Linker for solid-phase nucleic acid synthesis and its production method	2020-06-10
KR-20210145496-A	Acrylate based emulsion adhesive composition	2020-05-25
WO-2021235330-A1	Polarizing plate, display device, and method for manufacturing polarizing plate roll	2020-05-20
WO-2021199402-A1	Layered film, polarizing plate, display device, and method for manufacturing polarizing plate roll	2020-04-02
WO-2021201209-A1	Laminate film, polarizing plate, display device, and method for manufacturing polarizing plate roll	2020-04-02
WO-2021166722-A1	Vinyl chloride resin composition for powder molding, vinyl chloride resin molded article and laminate	2020-02-17

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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