1-(2,4,6-trichlorophenyl)-1H-pyrrole-2,5-dione

Inquiry

Molecular Formula:

C10H4Cl3NO2

Molecular Weight:

276.5

CAS Number:

13167-25-4

Catalog Number:

13167-25-4

Product Information

Molecular Formula:

C10H4Cl3NO2

Molecular Weight:

276.5

Description

1-(2,4,6-Trichlorophenyl)-1H-pyrrole-2,5-dione, a quintessential synthetic intermediate pervasive in the pharmaceutical sector, predominantly contributes to the genesis of antifungal drugs. It is widely used in research against fungal diseases such as candidiasis and aspergillosis.

Synonyms

N-(2,4,6-TRICHLOROPHENYL)MALEIMIDE; 1-(2,4,6-trichlorophenyl)-1h-pyrrole-2,5-dione; N-(2,4,6-TRICHLOROPEHNYL)MALEIMIDE; 1-(2,4,6-trichlorophenyl)-1H-pyrrole-2,5-dioneor N-(2,4,6-trichlorophenyl)maleimide ; IT-354; 1-(2,4,6-trichlorophenyl)-3-pyrroline-2,5-qu

IUPAC Name

1-(2,4,6-trichlorophenyl)pyrrole-2,5-dione

Canonical SMILES

C1=CC(=O)N(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C10H4Cl3NO2/c11-5-3-6(12)10(7(13)4-5)14-8(15)1-2-9(14)16/h1-4H

InChI Key

VHZJMAJCUAWIHV-UHFFFAOYSA-N

Boiling Point

400.3°C at 760 mmHg

Melting Point

134°C

Purity

>98.0%(LC)

Density

1.664 g/cm3

Appearance

White to Slight yellow Crystal

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

2.9

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

274.930761 g/mol

Monoisotopic Mass

274.930761 g/mol

Topological Polar Surface Area

37.4Å²

Heavy Atom Count

Formal Charge

Complexity

328

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
JP-2022040133-A	A photosensitive coloring composition for a color filter for a solid-state image sensor, a color filter, and a solid-state image sensor using the same.	2021-12-15
CN-113736059-A	Asparagus polyurea resin system with marine antifouling function and coating composition	2021-09-15
JP-2022008395-A	Red coloring composition for organic EL display device, color filter for organic EL display device and organic EL display device	2021-09-14
KR-102337085-B1	Mooring Rope for Floating Structure	2021-03-25
CN-112341805-A	Polyethylene-based fishing net composite material and preparation method thereof	2020-11-25
JP-2022039341-A	Coloring compositions, color filters, liquid crystal displays, and solid-state image sensors.	2020-08-28
JP-2022037872-A	Visible light shading photosensitive composition, visible light shading film, and sensor	2020-08-25
JP-2022028627-A	Antifouling paint composition	2020-08-03
JP-2022026877-A	Photosensitive composition for fingerprint sensor, optical filter, fingerprint sensor, and image display device	2020-07-31
WO-2022025096-A1	Epoxy resin-based anticorrosive coating composition, anticorrosive coating film, laminated antifouling coating film, antifouling substrate, and method for manufacturing antifouling substrate	2020-07-30

The molarity calculator equation

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

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The dilution calculator equation

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This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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