ChemicalBook--->CAS DataBase List--->115-31-1

115-31-1

115-31-1 Structure

115-31-1 Structure
IdentificationBack Directory
[Name]

ISOBORNYL THIOCYANOACETATE
[CAS]

115-31-1
[Synonyms]

IBTA
ent92
ENT 92
THANITE
Bornate
Cidalon
Thanisol
Terpinyl
THANITE(R)
thanite(herculespowder)
TERPINYL THIOCYANOACETATE
ISOBORNYL THIOCYANOACETATE
Isobornyl thiocyanatoacetate
isoborneol,thiocyanatoacetate
Isoborneol, thiocyanatoacetate
thiocyanatoaceticacidisobornylester
thiocyanato-aceticaciisobornylester
isobornylthiocyanatoacetate,technical
Thiocyanatoacetic acid isobornyl ester
isobornylesterkyselinythiokyanatooctove
Thiocyanatoacetic acid bornan-2-yl ester
Isobornylester kyseliny thiokyanatooctove
Acetic acid, thiocyanato-, isobornyl ester
1,7,7-trimethylnorbornan-2-ylthiocyanoacetate
Acetic acid, thiocyanato-, isobornyl ester, exo-
1,7,7-trimethylbicyclo(2.2.1)hept-2-ylthiocyanatoacetate
1,7,7-trimethylbicyclo(2,2,1)]hept-2-ylthiocyanatoacetate
exo-1,7,7-trimethylbicyclo[2.2.1]hept-2-ylthiocyanatoacetate
1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl (cyanosulfanyl)acetate
thiocyanatoaceticacid1,7,7-trimethylbicyclo[2.2.1]hept-2-ylester
thiocyanato-,1,7,7-trimethylbicyclo[2.2.1]hept-2-ylester,exo-aceticaci
thiocyanato-,1,7,7-trimethylbicyclo(2,2,1)hept-2-ylester,exo-aceticaci
thiocyanato-,1,7,7-trimethylbicyclo(2.2.1)hept-2-ylester,exo-aceticaci
Acetic acid, thiocyanato-, 1,7,7-trimethylbicyclo(2,2,1)hept-2-yl ester, exo-
Acetic acid, thiocyanato-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, exo-
1,7,7-trimethylbicyclo(2,2,1)hept-2-yl thiocyanatoacetate isobornyl thiocyanoacetate
Acetic acid, 2-thiocyanato-, (1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, rel-
[EINECS(EC#)]

204-081-5
[Molecular Formula]

C13H19NO2S
[MDL Number]

MFCD00155447
[MOL File]

115-31-1.mol
[Molecular Weight]

253.36
Chemical PropertiesBack Directory
[Definition]

The technical grade contains 82% or more of isobornyl thiocyanoacetate, also other terpenes and derivatives.
[Appearance]

Yellow oily liquid; terpene-like odor. Very soluble in alcohol, benzene, chloroform, and ether; practically insoluble in water. Combustible.
[Boiling point ]

bp0.06 95°
[density ]

d425 1.1465
[refractive index ]

nD25 1.512
[Fp ]

82°C (180°F)
[Henry's Law Constant]

3.8×101 mol/(m3Pa) at 25℃, HSDB (2015)
[EPA Substance Registry System]

Isobornyl thiocyanatoacetate (115-31-1)
Hazard InformationBack Directory
[Chemical Properties]

Yellow oily liquid; terpene-like odor. Very soluble in alcohol, benzene, chloroform, and ether; practically insoluble in water. Combustible.
[Uses]

Insecticide, especially in cattle sprays.
[Hazard]

Toxic by ingestion, strong irritant.
[Originator]

Bornate,Wyeth,US,1946
[Production Methods]

Isobornyl thiocyanoacetate is synthesised through a two-step process starting with camphene, a bicyclic monoterpene. First, camphene is reacted with chloroacetic acid at elevated temperatures for 16 hours, producing isobornyl monochloroacetate. This intermediate is then dissolved in ethyl alcohol, and potassium thiocyanate is added. The mixture is refluxed for approximately 8 hours, during which the chlorine atom is substituted by a thiocyanate group, yielding isobornyl thiocyanoacetate.
[Manufacturing Process]

200 g of camphene and 150 g of chloroacetic acid were heated 16 hours at 125°C, cooled to room temperature and the resulting product washed with water. In this way, 177 g of isobornyl monochloroacetate, analyzing 12.8%, by weight, chlorine was recovered. 174 g of the isobornyl monochloroacetate was dissolved in 300 cc of ethyl alcohol, 100 g of potassium thiocyanate added to this solution and the mixture refluxed for a period of 8 hours. 276 g of a product was recovered, which analyzed as follows: chlorine, 0.2% by wt. and sulfur, 10.9% by wt. This analysis shows the product to be principally isobornyl thiocyanoacetate.
[Therapeutic Function]

Pediculicide
[Pesticide Type]

Insecticide; Veterinary substance
Safety DataBack Directory
[Hazard Codes ]

Xn,N
[Risk Statements ]

22-50/53
[Safety Statements ]

24/25-60-61
[TSCA ]

TSCA listed
[Hazardous Substances Data]

115-31-1(Hazardous Substances Data)
[Toxicity]

guinea pig,LD50,oral,551mg/kg (551mg/kg),Farm Chemicals Handbook. Vol. -, Pg. C300, 1991.
115-31-1 suppliers list
Company Name: Sichuan Kulinan Technology Co., Ltd  
Telephone: 400-1166-196 18981987031
Website: http://www.hx-r.com/
Company Name: Shandong Ono Chemical Co., Ltd.  
Telephone: 0539-6362799 20)
Website: www.onochem.com
Company Name: Shaanxi Dideu Medichem Co. Ltd  
Telephone: 029-81024372 17792795018
Website: https://www.dideu.com/
Company Name: Tianjin Rongshen Chemical Co., Ltd  
Telephone: 18317763565; 18317763565
Website: https://www.chemicalbook.com/supplier/25873679
Company Name: Nantong Herun Biotechnology Co., Ltd  
Telephone: 18362409333
Website: www.chemicalbook.com/supplier/148205897/
Company Name: Mainchem Co., Ltd.  
Telephone: +86-0592-6210733
Website: https://www.mainchem.com
Company Name: Shaanxi Didu New Materials Co. Ltd  
Telephone: +86-86-17392712779 +86-13289823923
Website: www.dideu.com/en/
Tags:115-31-1 Related Product Information
372-09-8 124-76-5 25103-09-7 556-64-9 542-90-5 125-12-2 7659-86-1