Triflumuron solution in Methanol - 100μg/mL in Methanol，Uncertainty 3% , CAS No.64628-44-0

CAS: 64628-44-0 Cat. No.: BWY396491 분자식: C₁₅H₁₀ClF₃N₂O₃ 분자량: 358.7 Beilstein Registry Number: 2776684 EC 번호: 264-980-3

등급 & 순도 100μg/mL in Methanol，Uncertainty 3%

Synonyms

Triflumuron|64628-44-0|Trifluron|Triflumuron [ISO]|SIR 8514|2-Chloro-N-(((4-(trifluoromethoxy)phenyl)amino)carbonyl)benzamide|Alsystin|3FT64DYG8K|1-(o-chlorobenzoyl)-3-(p-(trifluoromethoxy)phenyl)urea|2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benz

Storage

Store at 2-8°C

Shipped In

Wet ice

사양

동의어

Triflumuron | 64628-44-0 | Trifluron | Triflumuron [ISO] | SIR 8514 | 2-Chloro-N-(((4-(trifluoromethoxy)phenyl)amino)carbonyl)benzamide | Alsystin | 3FT64DYG8K | 1-(o-chlorobenzoyl)-3-(p-(trifluoromethoxy)phenyl)urea | 2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benz

사양 및 순도

100μg/mL in Methanol，Uncertainty 3%

보관 조건

Store at 2-8°C

배송

Wet ice

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이름과 식별자

정식 스마일

C1=CC=C(C(=C1)C(=O)NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)Cl

IUPAC Name

2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide

InChIKey

XAIPTRIXGHTTNT-UHFFFAOYSA-N

INCHI

1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)

이성체 SMILES

C1=CC=C(C(=C1)C(=O)NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)Cl

WGK 독일

2

RTECS

CV2474000

분자량

358.7

Beilstein

2776684

Reaxy-Rn

2776684

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2776684&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass N-phenylureas
        • Level5 N-acyl-phenylureas
          • Level6 N-benzoyl-N'-phenylureas

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: N-phenylureas
• Intermediate Tree Nodes: N-acyl-phenylureas
• Direct Parent: N-benzoyl-N'-phenylureas
• Alternative Parents: 2-halobenzoic acids and derivatives Phenoxy compounds Phenol ethers Benzoyl derivatives Chlorobenzenes Aryl chlorides Vinylogous halides Ureas Trihalomethanes Carboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds Organofluorides Organonitrogen compounds Alkyl fluorides Organopnictogen compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: N-benzoyl-n'-phenylurea - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Vinylogous halide - Trihalomethane - Urea - Carbonic acid derivative - Carboxylic acid derivative - Alkyl fluoride - Organofluoride - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Halomethane - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as n-benzoyl-n'-phenylureas. These are n-acyl-phenylureas that have the acyl group substituted by a phenyl group.
• External Descriptors: Pesticides

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

관련 대상(인간)

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

관련 대상(비인간)

Plutella xylostella (1838 Activities)

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Spodoptera exigua (540 Activities)

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Spodoptera litura (1708 Activities)

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작용 메커니즘

화학 및 물리적 특성

• 분자량: 358.700 g/mol
• XLogP3: 5.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 358.033 Da
• Monoisotopic Mass: 358.033 Da
• Topological Polar Surface Area: 67.400 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 454.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

자주 묻는 질문

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 64628-44-0, the molecular formula is C15H10ClF3N2O3, and the molecular weight is 358.7 g/mol. InChIKey XAIPTRIXGHTTNT-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.