Di(2-ethylhexyl) Fumarate
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
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.
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].
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
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
16
Exact Mass
340.26135963 g/mol
Monoisotopic Mass
340.26135963 g/mol
Topological Polar Surface Area
52.6Ų
Heavy Atom Count
24
Formal Charge
0
Complexity
329
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
2
Defined Bond Stereocenter Count
1
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
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 |
