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Octhilinone

CAS 26530-20-1C11H19NOSMW 213.34

Octhilinone (CAS 26530-20-1) — formula C11H19NOS, molecular weight 213.34; category organic chemicals.

Specifications

CAS Number26530-20-1
Molecular FormulaC11H19NOS
Molecular Weight213.34
Melting Point15 °C at 101.325 kPa
Boiling Point248 °F at 0.01 mmHg (NTP, 1992)
LogPlog Kow = 2.45 at 24 °C
ApplicationsUses: Used as a preservative in polishes, paints, cleaners, adhesives, and metalworking fluids, Also used in wood and leather preservatives, [Kanerva, p. 1821], Metal Machining [Category: Heat or Machine], Painting (Pigments, Binders, and Biocides) [Category: Paint], Working with Glues and Adhesives [Category: Other], Applying Wood Preservatives [Category: Other], Using Disinfectants or Biocides [Category: Clean], Leather Tanning and Processing [Category: Industry], For octhilinone (USEPA, OPP Pesticide Code: 099901) ACTIVE products with label matches., SRP: Registered for use in the USA but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses., Control of apple and pear canker and other fungal and bacterial diseases of top fruit and citrus fruit. Also promotes rapid wound callousing of treated wounds and pruning cuts., Mildewcide, microbiocide, fungicide and bacteriocide., OIT is used to control sapstain and mold on wood via high pressure spray to logs that are processed to formulate plywood., For more Uses (Complete) data for Octhilinone (6 total), please visit the HSDB record page., Use Classification: EPA Safer Chemical Functional Use Classes -> Preservatives and Antioxidants, Safer Chemical Classes -> Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues, Household Products: Information on 61 consumer products that contain 2-N-octyl-4-isothiazolin-3-one in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Home Maintenance, • Inside the Home, Methods of Manufacturing: Octhilinone can be prepared by reaction of dithio-N-n-dioctylpropionamide and sulfuryl chloride., Preparation: S.N. Lewis et al., France patent 1555416 corresp to United States of America patent 3761488 (1969, 1973 to Rohm & Haas)., Formulations, Preparations: The National Pesticide Information Retrieval System (NPIRS) identifies 15 companies with active labels for products containing the chemical octhilinone. To view the complete list of companies, product names and percent octhilinone in formulated products click the following url and enter the CAS Registry number in the Active Ingredient field., Arch OIT 45 (Arch Chemicals, Inc.): Active ingredient: octhilinone 46.5%., Densil ND Antimicrobial (Arch Chemicals, Inc.): Active ingredient: diuron 15.0%, zinc pyrithione 10.0%, and octhilinone 3.0%., Busan 116 (Buckman Laboratories Inc.): Active ingredient: 2-(thiocyanomethylthio)benzothiazole 10.4% and octhilinone 2.2%., For more Formulations, Preparations (Complete) data for Octhilinone (28 total), U.S. Production: 2023: <50, 000 lb, 2022: <50, 2021: <50, 2020: <50, General Manufacturing Information: 3(2H)-Isothiazolone, 2-octyl-: ACTIVE
CategoryOrganic Chemicals

Where it is used

Documented applications: Uses: Used as a preservative in polishes, paints, cleaners, adhesives, and metalworking fluids, Also used in wood and leather preservatives, [Kanerva, p. 1821], Metal Machining [Category: Heat or Machine], Painting (Pigments, Binders, and Biocides) [Category: Paint], Working with Glues and Adhesives [Category: Other], Applying Wood Preservatives [Category: Other], Using Disinfectants or Biocides [Category: Clean], Leather Tanning and Processing [Category: Industry], For octhilinone (USEPA, OPP Pesticide Code: 099901) ACTIVE products with label matches., SRP: Registered for use in the USA but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses., Control of apple and pear canker and other fungal and bacterial diseases of top fruit and citrus fruit. Also promotes rapid wound callousing of treated wounds and pruning cuts., Mildewcide, microbiocide, fungicide and bacteriocide., OIT is used to control sapstain and mold on wood via high pressure spray to logs that are processed to formulate plywood., For more Uses (Complete) data for Octhilinone (6 total), please visit the HSDB record page., Use Classification: EPA Safer Chemical Functional Use Classes -> Preservatives and Antioxidants, Safer Chemical Classes -> Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues, Household Products: Information on 61 consumer products that contain 2-N-octyl-4-isothiazolin-3-one in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Home Maintenance, • Inside the Home, Methods of Manufacturing: Octhilinone can be prepared by reaction of dithio-N-n-dioctylpropionamide and sulfuryl chloride., Preparation: S.N. Lewis et al., France patent 1555416 corresp to United States of America patent 3761488 (1969, 1973 to Rohm & Haas)., Formulations, Preparations: The National Pesticide Information Retrieval System (NPIRS) identifies 15 companies with active labels for products containing the chemical octhilinone. To view the complete list of companies, product names and percent octhilinone in formulated products click the following url and enter the CAS Registry number in the Active Ingredient field., Arch OIT 45 (Arch Chemicals, Inc.): Active ingredient: octhilinone 46.5%., Densil ND Antimicrobial (Arch Chemicals, Inc.): Active ingredient: diuron 15.0%, zinc pyrithione 10.0%, and octhilinone 3.0%., Busan 116 (Buckman Laboratories Inc.): Active ingredient: 2-(thiocyanomethylthio)benzothiazole 10.4% and octhilinone 2.2%., For more Formulations, Preparations (Complete) data for Octhilinone (28 total), U.S. Production: 2023: <50, 000 lb, 2022: <50, 2021: <50, 2020: <50, General Manufacturing Information: 3(2H)-Isothiazolone, 2-octyl-: ACTIVE.

Purchase Profile

What this product is

Octhilinone is a carbon-based organic compound with CAS registry number 26530-20-1 and molecular formula C11H19NOS (molecular weight 213.34), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 26530-20-1

Its molecular formula C11H19NOS comprises 11 C, 19 H, 1 N, 1 O, 1 S atoms.

Also known as: Octhilinone

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Octhilinone?

The CAS registry number of Octhilinone is 26530-20-1.

What is the molecular formula and molecular weight of Octhilinone?

Molecular formula C11H19NOS, molecular weight 213.34.

What other names is Octhilinone known by?

It is also registered under: Octhilinone.

What are the documented applications of Octhilinone?

Recorded applications: Uses: Used as a preservative in polishes, paints, cleaners, adhesives, and metalworking fluids, Also used in wood and leather preservatives, [Kanerva, p. 1821], Metal Machining [Category: Heat or Machine], Painting (Pigments, Binders, and Biocides) [Category: Paint], Working with Glues and Adhesives [Category: Other], Applying Wood Preservatives [Category: Other], Using Disinfectants or Biocides [Category: Clean], Leather Tanning and Processing [Category: Industry], For octhilinone (USEPA, OPP Pesticide Code: 099901) ACTIVE products with label matches., SRP: Registered for use in the USA but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses., Control of apple and pear canker and other fungal and bacterial diseases of top fruit and citrus fruit. Also promotes rapid wound callousing of treated wounds and pruning cuts., Mildewcide, microbiocide, fungicide and bacteriocide., OIT is used to control sapstain and mold on wood via high pressure spray to logs that are processed to formulate plywood., For more Uses (Complete) data for Octhilinone (6 total), please visit the HSDB record page., Use Classification: EPA Safer Chemical Functional Use Classes -> Preservatives and Antioxidants, Safer Chemical Classes -> Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues, Household Products: Information on 61 consumer products that contain 2-N-octyl-4-isothiazolin-3-one in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Home Maintenance, • Inside the Home, Methods of Manufacturing: Octhilinone can be prepared by reaction of dithio-N-n-dioctylpropionamide and sulfuryl chloride., Preparation: S.N. Lewis et al., France patent 1555416 corresp to United States of America patent 3761488 (1969, 1973 to Rohm & Haas)., Formulations, Preparations: The National Pesticide Information Retrieval System (NPIRS) identifies 15 companies with active labels for products containing the chemical octhilinone. To view the complete list of companies, product names and percent octhilinone in formulated products click the following url and enter the CAS Registry number in the Active Ingredient field., Arch OIT 45 (Arch Chemicals, Inc.): Active ingredient: octhilinone 46.5%., Densil ND Antimicrobial (Arch Chemicals, Inc.): Active ingredient: diuron 15.0%, zinc pyrithione 10.0%, and octhilinone 3.0%., Busan 116 (Buckman Laboratories Inc.): Active ingredient: 2-(thiocyanomethylthio)benzothiazole 10.4% and octhilinone 2.2%., For more Formulations, Preparations (Complete) data for Octhilinone (28 total), U.S. Production: 2023: <50, 000 lb, 2022: <50, 2021: <50, 2020: <50, General Manufacturing Information: 3(2H)-Isothiazolone, 2-octyl-: ACTIVE.

Which category does Octhilinone belong to?

Category: Organic Chemicals.

PubChem Public Data

Public-database records for Octhilinone (CAS 26530-20-1), reproduced here for independent cross-checking.

Safety classification and hazard statements

GHS notification summary0.1% (1 / 1404)
Reported hazard statementsH301, H311, H314, H317, H318, H330, H400, H410

H301: Toxic if swallowed [Danger Acute toxicity, oral]

H311: Toxic in contact with skin [Danger Acute toxicity, dermal]

Regulatory listings

Regulatory & Food ContactFDA Inventory of Effective Food Contact Substance (FCS) Noti: FCS
2-n-octyl-4-isothiazolin-3-one(OIT) (CAS Reg. No. 26530-20-1)
The FCS is intended for use as an antimicrobial active ingredient of industrial technical formulations for use
2-n-octyl-4-isothiazolin-3-one (CAS Reg. No. 26530-20-1)
GHS notification summary0.1% (1 / 1404)

Physical description and handling notes

  • 2-octyl-3-isothiazolone is a clear dark amber liquid. Used as a fungicide.
  • Clear dark amber liquid; [CAMEO]
  • Liquid
  • Light, golden yellow, clear liquid
  • Very weak, sharp smell
  • greater than 200 °F (NTP, 1992)

Reported physical properties

沸点248 °F at 0.01 mmHg (NTP, 1992)
沸点BP: 120 °C at 0.01 mm Hg
熔点15 °C at 101.325 kPa
密度1.03
蒸气压2.98 mmHg at 77 °F (NTP, 1992)
蒸气压0.0000368 [mmHg]
蒸气压3.68X10-5 mm Hg (4.9 mPa) at 25 °C
LogPlog Kow = 2.45 at 24 °C
LogP2.45
黏度48.04 sq mm.s at 20 °C; 17.94 sq mm.s at 30 °C

How this substance is indexed

CAS Registry Number26530-20-1
PubChem CID33528
分子式C11H19NOS
IUPAC 名称2-octyl-1,2-thiazol-3-one
UNII(FDA)4LFS24GD0V

Documented uses

  • Used as a preservative in polishes, paints, cleaners, adhesives, and metalworking fluids; Also used in wood and leather preservatives; [Kanerva, p. 1821]
  • Metal Machining [Category: Heat or Machine]
  • Painting (Pigments, Binders, and Biocides) [Category: Paint]
  • Working with Glues and Adhesives [Category: Other]
  • Applying Wood Preservatives [Category: Other]
  • Using Disinfectants or Biocides [Category: Clean]

Names this substance appears under

Octhilinone; 26530-20-1; 2-n-Octyl-4-isothiazolin-3-one; 2-Octyl-4-isothiazolin-3-one; Pancil; 2-Octyl-2H-isothiazol-3-one; 2-Octyl-3-isothiazolone; 2-Octyl-3(2H)-isothiazolone; Skane 8; Micro-chek skane; 3(2H)-Isothiazolone, 2-octyl-; Pancil-T; Kathon LM; Microbicide M-8; Micro-chek 11; Micro-chek 11D

Computed molecular descriptors

分子量213.34
XLogP33.5
氢键供体数0
氢键受体数2
可旋转键数7
精确质量213.11873540
单同位素质量213.11873540
拓扑极性表面积45.6
重原子数14
形式电荷0

Database abstract

N-Octyl-4-isothiazolin-3-one · CAS 26530-20-1 · C11H19NOS. UNII 4LFS24GD0V. 沸点: 248 °F at 0.01 mmHg (NTP, 1992); 沸点: BP: 120 °C at 0.01 mm Hg; 熔点: 15 °C at 101.325 kPa.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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