N-Trichloromethylthiobenzothiazolone

3-(trichloromethylsulfanyl)-1,3-benzothiazol-2-one

CAS: 3567-79-1

Molecular Formula	`C8H4Cl3NOS2`
Molecular Weight	300.6 g/mol
LogP	4.4
Topological Polar Surface Area	70.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	1
Exact Mass	298.87997
Heavy Atoms	15
Complexity	271.0

Chemical Identifiers

CAS Number	3567-79-1
SMILES	`C1=CC=C2C(=C1)N(C(=O)S2)SC(Cl)(Cl)Cl`
InChIKey	`MKPFMPWXGYOEPF-UHFFFAOYSA-N`

📖 Product Overview

N-Trichloromethylthiobenzothiazolone (CAS: 3567-79-1) is a chemical compound with molecular formula C8H4Cl3NOS2 and molecular weight 300.6 g/mol. Its IUPAC systematic name is 3-(trichloromethylsulfanyl)-1,3-benzothiazol-2-one. LogP 4.4 Topological Polar Surface Area 70.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 1 Exact Mass 298.87997 Heavy Atoms 15 Complexity 271.0 InChI Key: MKPFMPWXGYOEPF-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)N(C(=O)S2)SC(Cl)(Cl)Cl.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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