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1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate | CAS No. 134605-64-4

1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate

Basic Information

Chemical_Structure_Of
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CAS Number

134605-64-4

Molecular Formula

C20H18ClF3N2O6

Molecular Weight

474.82 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Esters
Basic Chemical Raw Materials Organic Chemicals Ethers
Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds
Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates
Fine Chemicals Dyes and Pigments Organic Dyes
Fine Chemicals Surfactants Anionic Surfactants
Fine Chemicals Specialty Chemicals UV Stabilizers
Agricultural Chemicals Pesticides Herbicides
Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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CC(C)(C(=O)OCC=C)OC(=O)C1=C(C=CC(=C1)N2C(=O)C=C(N(C2=O)C)C(F)(F)F)Cl

InChI

InChI=1S/C20H18ClF3N2O6/c1-5-8-31-17(29)19(2,3)32-16(28)12-9-11(6-7-13(12)21)26-15(27)10-14(20(22,23)24)25(4)18(26)30/h5-7,9-10H,1,8H2,2-4H3

InChIKey

JEDYYFXHPAIBGR-UHFFFAOYSA-N

LogP

2.873000000000001

Topological Polar Surface Area

96.6 Ų

Hydrogen Bond Donor/Acceptor

0 / 8

Complexity

842

Safety Information

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GHS Hazard Pictograms

H400H400

Hazard Statement

H400 Very toxic to aquatic life
Hazardous to the aquatic environment, acute hazard

Synonyms & References

English

  • 1-(allyloxy)-2-methyl-1-oxopropan-2-yl 2-chloro-5-(3-methyl-2,6-dioxo-4-(trifluoromethyl)-2,3-dihydropyrimidin-1(6H)-yl)benzoate
  • 1-(ALLYLOXYCARBONYL)-1-METHYLETHYL 2-CHLORO-5-(1,2,3,6-TETRAHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)PYRIMIDIN-1-YL)BENZOATE
  • NCGC00168293-01
  • CGA-276854
  • Touchdown B-Power
  • CAS-134605-64-4
  • 1,1-DIMETHYL-2-OXO-2-(2-PROPENYLOXY)ETHYL 2-CHLORO-5-(3,6-DIHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-1(2H)-PYRIMIDINYL)BENZOATE
  • EC 603-837-5
  • Butafenacil allyl
  • BUTAFENACIL [ISO]
  • NCGC00255044-01
  • CS-0011421
  • Butafenacil [ISO:BSI]
  • Nanogen Index code BUL (NIUS)
  • DTXCID7014365
  • Fluobutracil
  • INSPIRE
  • 7Z141CCP2R
  • NS00006629
  • Butafenacil 10 microg/mL in Acetonitrile
  • CHEMBL1867342
  • 134605-64-4
  • (2-Allyloxy-1,1-dimethyl-2-oxo-ethyl) 2-chloro-5-(3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidin-1-yl)benzoate
  • Butafenacil, PESTANAL(R), analytical standard
  • Butafenacil
  • 1-(allyloxycarbonyl)-1-methylethyl 2-chloro-5-[1,2,3,6-tetrahydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate
  • Benzoic acid, 2-chloro-5-(3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl)-, 1,1-dimethyl-2-oxo-2-(2-propenyloxy)ethyl ester
  • CHEBI:143863
  • 1,1-dimethyl-2-oxo-2-(2-propen-1-yloxy)ethyl 2-chloro-5-[3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]benzoate
  • BENZOIC ACID,2-CHLORO-5-[3,6-DIHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-1(2H)-PYRIMIDINYL]-,1,1-DIMETHYL-2-OXO-2-(2-PROPEN-1-YLOXY)ETHYL ESTER
  • J-006565

MDL Number

MFCD05865280

FAQ

What is 1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate (CAS: 134605-64-4)?
1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate is a complex organic compound with a unique chemical structure. It is primarily used in pharmaceutical and research applications. This compound has a molecular formula of C20H16ClF3N3O6 and a molecular weight of approximately 480.09 g/mol. It exhibits specific physical properties and characteristics relevant to its intended applications.

What are the main uses of 1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate (CAS: 134605-64-4)?
1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate is primarily used in the pharmaceutical industry for medicinal purposes. It also finds applications in research for its unique chemical properties and in certain industrial processes, although its specific industrial applications are limited.

Is 1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate (CAS: 134605-64-4) safe?
1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate, like other chemical compounds, requires proper handling to ensure safety. It is important to follow all safety guidelines, including the use of appropriate personal protective equipment (PPE) and storing it in a secure location away from flammable materials. It is not generally considered safe for direct skin contact or ingestion and should be handled with care in accordance with safety data sheets (SDS).

How should 1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate (CAS: 134605-64-4) be stored?
1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation. Storage conditions should be controlled to maintain the compound's stability and effectiveness. It is recommended to keep it at a temperature between 15-25°C and away from moisture and other reactive materials.

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1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate — HuBeiAnAo Biotechnology Co Ltd

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1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate — HuBeiJiFeiYiYao Chemical Co Ltd

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1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate — Hubei Dahao Chemical Co., Ltd.

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1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate — TianMenHengChang Chemical Co Ltd

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1-(Allyloxy)-2-methyl-1-oxo-2-propanyl 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl]benzoate — HuBeiBaiDuHuaXue Co Ltd

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