N-(2,4,6-Trichlorophenyl)maleimide CAS#: 13167-25-4; 凯望编码 (ChemWhat Code): 133237

IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

英文名N-(2,4,6-Trichlorophenyl)maleimide
IUPAC Namepyridin-3-amine
分子结构Structure of N-(2,4,6-Trichlorophenyl)maleimide CAS 13167-25-4
CAS编号 13167-25-4
EINECS NumberNo data available
MDL NumberNo data available
Beilstein Registry NumberNo data available
别名N-(2,4,6-trichlorophenyl)maleimide
分子式C10H4Cl3NO2
分子量276.5
InChIInChI=1S/C10H4Cl3NO2/c11-5-3-6(12)10(7(13)4-5)14-8(15)1-2-9(14)16/h1-4H
InChI KeyVHZJMAJCUAWIHV-UHFFFAOYSA-N
Canonical SMILESC1=CC(=O)N(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl
Patent Information
Patent IDTitlePublication Date
CN115353477Preparation method of bis-selenomaleimide compound2022
US2003/191091Use of riboflavin and flavin derivatives as chitinase inhibitors2003

Physical Data

AppearanceLight yellow powder
SolubilityNo data available
Flash PointNo data available
Refractive indexNo data available
SensitivityNo data available
Melting Point, °C Solvent (Melting Point)
134

Spectra

Description (NMR Spectroscopy)Nucleus (NMR Spectroscopy)
Chemical shifts, Spectrum1H
N-(2,4,6-Trichlorophenyl)maleimide CAS#: 13167-25-4 NMRHNMR of N-(2,4,6-Trichlorophenyl)maleimide CAS 13167-25-4
Description (IR Spectroscopy)
Bands, Spectrum

Route of Synthesis (ROS)

Route of Synthesis (ROS) of N-(2,4,6-Trichlorophenyl)maleimide CAS# 13167-25-4
Route of Synthesis (ROS) of N-(2,4,6-Trichlorophenyl)maleimide CAS# 13167-25-4
ConditionsYield
With silver hexafluoroantimonate; dichloro(pentamethylcyclopentadienyl)rhodium (III) dimer; silver(l) oxide In 2,2,2-trifluoroethanol at 80℃; for 3h;61%

Safety and Hazards

Pictogram(s)exclamation-mark
SignalWarning
GHS Hazard StatementsH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Information may vary between notifications depending on impurities, additives, and other factors.
Precautionary Statement CodesP264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364
(The corresponding statement to each P-code can be found at the GHS Classification page.)

Other Data

TransportationNONH for all modes of transport
Under the room temperature and away from light
HS CodeNo data available
StorageUnder the room temperature and away from light
Shelf Life2 years
Market PriceUSD
Druglikeness
Lipinski rules component
分子量276.506
logP2.898
HBA3
HBD0
Matching Lipinski Rules4
Veber rules component
Polar Surface Area (PSA)37.38
Rotatable Bond (RotB)1
Matching Veber Rules2
Use Pattern
Ingredient of an antifouling paint
High-performance polymer intermediates
This compound is often used to prepare heat-resistant and insulating polymers, such as polyimide and maleimide copolymers; it can be used as a comonomer of thermosetting resins to give the material high strength and thermal oxygen stability; chlorine atoms enhance the flame retardancy and chemical corrosion resistance of the material.
Used in aerospace composites; high-end electronic/electrical insulation materials; high-temperature adhesives or coatings.
Photosensitive materials and crosslinkers
The maleimide structure makes it suitable for UV curing and thermal crosslinking systems; the structure has high rigidity and is often used as a monomer for photoresists, liquid crystal orienting agents or photosensitive polymers; it can be used in conjunction with photoinitiators for electronic packaging materials.
Pharmaceutical or pesticide intermediates (potential)
Chloroaryl groups have certain antibacterial, antifungal or insecticidal properties, and can theoretically be used as precursors for certain pesticide or pharmaceutical active molecules; maleimide groups are often used to synthesize heterocyclic drug candidates with diverse structures (such as the parent nucleus of anticancer and antiviral drugs);
Special additives or functional coating materials
Trichlorosubstituted groups make them hydrophobic and antimicrobial; they can be used to synthesize antibacterial polymer coatings, functionalize the surface of medical devices, and modify membrane materials; they are suitable for coating systems with solvent resistance, scratch resistance, and anti-aging functions.

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