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Benzoisothiazol-3-one-[13C6]

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Application Area

Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

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In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Benzoisothiazol-3-one-[13C6]

Name: Benzoisothiazol-3-one-[13C6]
Brand: BOC Sciences
Rating: 5 (1 reviews)

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General Information
Catalog: BLP-007980
CAS: 1329616-16-1
Molecular Formula: C[13C]6H5NOS
Molecular Weight: 157.14

Chemical Structure

Description	Benzoisothiazol-3-one-[13C6] is the labelled analogue of Benzothiazolinone. Benzothiazolinone is widely used as a biological pesticide, which is an antimicrobial agent.
Synonyms	1,2-Benzisothiazol-3(2h)-one (ring-13C6); Benzoisothiazol-3-one-13C6; 3-Hydroxy-1,2-benzisothiazole-13C6; Acticide BIT-13C6; Apizas AP-DS-13C6; BIT-13C6; Benzisothiazolone-13C6; Benzo[d]isothiazol-3(2H)-one-13C6; Benzocil-13C6; Canguard BIT-13C6; Proxel BD-13C6
IUPAC Name	benzo[d]isothiazol-3(2H)-one-3a,4,5,6,7,7a-13C6
Related CAS	2634-33-5 (unlabelled)
Canonical SMILES	C1=CC=C2C(=C1)C(=O)NS2
InChI	InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)/i1+1,2+1,3+1,4+1,6+1
InChI Key	DMSMPAJRVJJAGA-ZFKNMOOESA-N
Melting Point	134-137°C
Purity	≥99%; ≥98% atom 13C
Solubility	Slightly soluble in DMSO, Methanol
Appearance	Off-white to Brown Solid
Storage	Store at -20°C