Diallyl Isophthalate
Product Information
Molecular Formula
C14H14O4
Molecular Weight
246.26
Description
Diallyl Isophthalate serves as an efficacious agent for diverse ailments. With its remarkable attributes as an antioxidant and anti-inflammatory entity, it assumes paramount importance in the realm of pharmaceutical formulations targeting the amelioration of disorders linked to oxidative stress and inflammation. This substance imparts its curative prowess to combat cardiovascular afflictions, cancerous proliferation, and degenerative neurological maladies.
Synonyms
Isophthalic Acid Diallyl Ester
IUPAC Name
bis(prop-2-enyl) benzene-1,3-dicarboxylate
SMILES
C=CCOC(=O)C1=CC(=CC=C1)C(=O)OCC=C
InChI
InChI=1S/C14H14O4/c1-3-8-17-13(15)11-6-5-7-12(10-11)14(16)18-9-4-2/h3-7,10H,1-2,8-9H2
InChI Key
OOORLLSLMPBSPT-UHFFFAOYSA-N
Boiling Point
163 °C/8 mmHg
Flash Point
163 °C
Purity
>98.0%(GC)(T)
Appearance
Colorless to Almost colorless clear liquid
Application
Used for polyester, alkyd, polyurethane, and other high polymers and plasticizers.
Storage
0-10°C
Safety Information
Hazards
H302:
Harmful if swallowed.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Harmful if swallowed.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P270:
Do not eat, drink or smoke when using this product.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312+P330:
IF SWALLOWED:
Call a POISON CENTER or doctor/physician if you feel unwell.
Rinse mouth.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Wash thoroughly after handling.
P270:
Do not eat, drink or smoke when using this product.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312+P330:
IF SWALLOWED:
Call a POISON CENTER or doctor/physician if you feel unwell.
Rinse mouth.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Computed Properties
XLogP3
2.9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
8
Exact Mass
246.08920892 g/mol
Monoisotopic Mass
246.08920892 g/mol
Topological Polar Surface Area
52.6Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
292
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-114196099-A | Polyolefin resin foamed sheet and preparation method thereof | 2022-02-18 |
| JP-2022019933-A | Cross-linked polyolefin resin foam, method for producing cross-linked polyolefin resin foam, and concave molded product | 2021-12-02 |
| CN-114045132-A | Tile back glue emulsion and preparation and detection method thereof | 2021-11-29 |
| CN-114163670-A | Energy-saving and environment-friendly epoxy vinyl ester resin prepreg and preparation method and curing method thereof | 2021-11-16 |
| CN-114094102-A | Secondary battery | 2021-11-03 |
| JP-2022009139-A | Radiation-sensitive resin composition | 2021-10-14 |
| CN-113736424-A | Single-component thermosetting polyurethane structural adhesive and preparation method thereof | 2021-09-30 |
| CN-113999113-A | Motion protection type lens resin monomer, preparation method and production system thereof | 2021-09-26 |
| CN-215816366-U | Antenna assembly | 2021-09-23 |
| CN-113842146-A | Single-pair tooth occlusal force measuring device | 2021-09-06 |
