2-Vinyl-1H-isoindole-1,3(2H)-dione
Product Information
Molecular Formula
C10H7NO2
Molecular Weight
173.1700
Description
2-Vinyl-1H-isoindole-1,3(2H)-dione is the most important compound in the biomedical field. Its indispensability is highlighted by its widespread inclusion in drug formulations targeting a variety of diseases, including cancer, inflammation, and microbial infections.
Synonyms
2-Vinyl-1H-isoindole-1,3(2H)-dione
IUPAC Name
2-ethenylisoindole-1,3-dione
SMILES
C=CN1C(=O)C2=CC=CC=C2C1=O
InChI
InChI=1S/C10H7NO2/c1-2-11-9(12)7-5-3-4-6-8(7)10(11)13/h2-6H,1H2
InChI Key
IGDLZDCWMRPMGL-UHFFFAOYSA-N
Boiling Point
151°C / 9mmHg
Melting Point
84-86°C(lit.)
Flash Point
217 °C
Purity
95%
Density
1.402g/cm3
Appearance
off-white to light yellow crystalline powder
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
1.8
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
173.047678466 g/mol
Monoisotopic Mass
173.047678466 g/mol
Topological Polar Surface Area
37.4Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
248
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 |
|---|---|---|
| JP-2022033265-A | Adhesive sheets, repetitive bending laminated members and repetitive bending devices | 2022-01-04 |
| CN-114015336-A | Scratch-resistant and wear-resistant folding-resistant explosion-proof water-based plastic replacement oil and preparation method thereof | 2021-11-12 |
| CN-113881236-A | Preparation method of flame-retardant low-temperature-resistant organic silicon rubber | 2021-11-01 |
| JP-2022028701-A | Colored adhesive sheet and display | 2021-11-01 |
| CN-114045605-A | Warp-knitted electric blanket fabric and preparation method thereof | 2021-09-26 |
| CN-113773574-A | B1-grade flame-retardant irradiation crosslinking insulated cable material | 2021-09-22 |
| CN-113801395-A | Preparation process of B1-grade flame-retardant low-smoke halogen-free insulated cable material | 2021-09-22 |
| JP-2021152156-A | Thermoplastic elastomer composition, molded article, laminated structure and method for manufacturing the laminated structure | 2021-04-27 |
| JP-6936406-B1 | Improved material surface modification | 2021-01-15 |
| JP-2021050353-A | Adhesive sheet, display body and manufacturing method of display body | 2020-12-10 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22782739 | 2012-08-06 | New tetraphosphorus ligands for highly linear selective hydroformylation of allyl and vinyl derivatives | Chemistry (Weinheim an der Bergstrasse, Germany) |
| 16370584 | 2006-01-01 | Photoinduced addition of phthalimide to unactivated alkynes | Photochemistry and photobiology |
| 11506634 | 2001-08-23 | Catalytic cyclopropanation of alkenes using diazo compounds generated in situ. A novel route to 2-arylcyclopropylamines | Organic letters |
