Diuron Solution in Methanol - 1000μg/mL in Methanol, uncertainty 2% , CAS No.330-54-1

CAS: 330-54-1 Cat. No.: BWY397712 Fórmula: C₉H₁₀Cl₂N₂O Peso molecular: 233.09 Beilstein Registry Number: 2215168 Número CE: 206-354-4

GRADE & PURITY 1000μg/mL in Methanol, uncertainty 2%

Synonyms

diuron|330-54-1|3-(3,4-Dichlorophenyl)-1,1-dimethylurea|DCMU|Duran|Dynex|Dichlorfenidim|Herbatox|Vonduron|Dailon|Karmex|Marmer|Karmex DW|Di-on|Cekiuron|Crisuron|Lucenit|Unidron|1,1-Dimethyl-3-(3,4-dichlorophenyl)urea|1-(3,4-Dichlorophenyl)-3,3-dimethylure

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

diuron | 330-54-1 | 3-(3,4-Dichlorophenyl)-1,1-dimethylurea | DCMU | Duran | Dynex | Dichlorfenidim | Herbatox | Vonduron | Dailon | Karmex | Marmer | Karmex DW | Di-on | Cekiuron | Crisuron | Lucenit | Unidron | 1,1-Dimethyl-3-(3,4-dichlorophenyl)urea | 1-(3,4-Dichlorophenyl)-3,3-dimethylure

Especificações e pureza

1000μg/mL in Methanol, uncertainty 2%

Condições de armazenamento de armazenamento

Store at 2-8°C

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Nomes e identificadores

Sorrisos canónicos

CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl

IUPAC Name

3-(3,4-dichlorophenyl)-1,1-dimethylurea

InChIKey

XMTQQYYKAHVGBJ-UHFFFAOYSA-N

INCHI

1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)

SMILES isoméricas

CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl

WGK Alemanha

3

RTECS

YS8925000

Número UN

3077

Grupo de embalagem

III

Peso molecular

233.09

Beilstein

2215168

Reaxy-Rn

2215168

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2215168&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass N-phenylureas

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: N-phenylureas
• Intermediate Tree Nodes: Not available
• Direct Parent: N-phenylureas
• Alternative Parents: Dichlorobenzenes Aryl chlorides Ureas Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: N-phenylurea - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Urea - Carbonic acid derivative - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
• External Descriptors: Phenylurea herbicides

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

Alvos associados (humanos)

AHR Tclin Aryl hydrocarbon receptor (1071 Activities)

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APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)

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SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)

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Alvos associados (não humanos)

Saccharomyces cerevisiae (19171 Activities)

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Spinacia oleracea (250 Activities)

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Plasmodium falciparum (966862 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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Chlorella vulgaris (142 Activities)

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Gossypium hirsutum (233 Activities)

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Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

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Protoporphyrinogen IX oxidase (35 Activities)

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psbA Photosystem Q(B) protein (72 Activities)

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petD Cytochrome b6-f complex subunit 4 (179 Activities)

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Auxenochlorella protothecoides (8 Activities)

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Vigna radiata var. radiata (22 Activities)

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Poa annua (183 Activities)

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Erigeron canadensis (118 Activities)

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Scenedesmus acutus (534 Activities)

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Mecanismos de ação

Propriedades químicas e físicas

• Ponto de fusão (°C): 158-159°C
• Peso molecular: 233.090 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 232.017 Da
• Monoisotopic Mass: 232.017 Da
• Topological Polar Surface Area: 32.299 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 211.000
• 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

Perguntas frequentes

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 330-54-1, the molecular formula is C9H10Cl2N2O, and the molecular weight is 233.09 g/mol. InChIKey XMTQQYYKAHVGBJ-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.