5316-87-0

Basic information

• Product Name: 2(3H)-Benzothiazolone, 3-[(4-nitrophenyl)methyl]-
• CAS NO: 5316-87-0
• Molecular Formula: C14H10N2O3S
• Molecular Weight: 286.311
• Mol File: 5316-87-0.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 2(3H)-Benzothiazolone, 3-[(4-nitrophenyl)methyl]-(CAS DataBase Reference)
• NIST Chemistry Reference: 2(3H)-Benzothiazolone, 3-[(4-nitrophenyl)methyl]-(5316-87-0)
• EPA Substance Registry System: 2(3H)-Benzothiazolone, 3-[(4-nitrophenyl)methyl]-(5316-87-0)

Safety Data

• Hazardous Substances Data: 5316-87-0(Hazardous Substances Data)

Usage

Structure

Benzothiazolone derivative with a 4-nitrophenylmethyl substituent

Usage

Commonly used in the synthesis of various organic compounds

Applications

Pharmaceutical and agrochemical industries

Biological activities

Exhibits various biological activities

Potential uses

May have potential uses as a therapeutic agent

Additional uses

May have uses as a reagent in organic and medicinal chemistry research.

Upstream product

• 95-16-9 1,3-Benzothiazole 
• 63321-86-8 2-methoxybenzothiazole 
• 100-11-8 1-bromomethyl-4-nitro-benzene 

Relevant articles and documents

Metal-free C(sp2)-H functionalization of azoles: K2CO3/I2-mediated oxidation, imination, and amination

The direct C2-H oxidation and imination of a wide variety of azoles was achieved by using a commercially available simple K2CO3/I2 reagent combination. The iodinated azole adduct, produced via the in situ generation of N-heterocyclic carbene, is the key intermediate for C2-H oxidation, imination, and amination of azoles. Significantly, these reactions proceed under mild conditions with high to excellent yields, are scalable to large quantity and exhibit a broad substrate scope. Interestingly, this direct C2-H imination method allowed us to access various pharmacologically active N6-alkyl or N6-aryl substituted benzimidazoquinazolinone scaffolds through intramolecular C-H imination in a sequential one-pot reaction.