46078

2-Octyl-4-isothiazolin-3-one

PESTANAL^®, analytical standard

• Synonym(s): 2-Octyl-3(2H)-isothiazolone, Octhilinone
• Empirical Formula (Hill Notation): C₁₁H₁₉NOS
• CAS Number: 26530-20-1
• Molecular Weight: 213.34
• UNSPSC Code: 41116107
• NACRES: NA.24
• PubChem Substance ID: 329756598
• EC Number: 247-761-7
• Beilstein/REAXYS Number: 1211137
• MDL number: MFCD00072473

Properties

• grade: analytical standard
• Quality Segment: 100
• product line: PESTANAL^®
• shelf life: limited shelf life, expiry date on the label
• application(s): agriculture; environmental
• format: neat
• SMILES string: CCCCCCCCN1SC=CC1=O
• InChI: 1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3
• InChI key: JPMIIZHYYWMHDT-UHFFFAOYSA-N

Description

Application

• Nonthermal Plasma in Wastewater Treatment: This research utilized nonthermal plasma-based advanced oxidation processes (AOPs) for degrading micropollutants, including isothiazolinones, in wastewater. The study underscores the effectiveness of 2-Octyl-4-isothiazolin-3-one in microbial growth control, providing insights into its applications in wastewater management and microbial contamination control (Chen et al., 2023).
• Surface Interactions of Semi-Volatile Isothiazolinones: The study quantified the equilibria of semi-volatile isothiazolinones, such as 2-Octyl-4-isothiazolin-3-one, between air and glass surfaces, using techniques like gas chromatography and Raman spectroscopy. This research is vital for understanding the stability and persistence of 2-Octyl-4-isothiazolin-3-one in various environments, particularly its use in biotech applications (Sohn et al., 2023).

Legal Information

PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

Safety Information

• pictograms: GHS06,GHS05,GHS09
• signalword: Danger
• hcodes: H301 + H311,H314,H317,H330,H410
• pcodes: P260 - P273 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 2 Inhalation - Acute Tox. 3 Dermal - Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Eye Dam. 1 - Skin Corr. 1B - Skin Sens. 1A
• supp_hazards: EUH071
• Storage Class: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter