Metaldehyde - ≥97% , CAS No.108-62-3

CAS: 108-62-3 Cat. No.: M110038 Peso molecular: 176.21 Beilstein Registry Number: 19(3/4)5643 Número EC: 203-600-2

GRADE & PURITY ≥97%

Synonyms

Blitzem | Metaldeide [Italian] | 1,3,5,7-Tetroxocane, 2,4,6,8-tetramethyl- | FT-0693272 | M0076 | HSDB 1735 | MFCD00134115 | Acetaldehyde Tetramer | Cekumeta | 2,4,6,8-Tetramethyl-1,3,5,7-tetraoxocane | Ariotox | Metacetaldehyde | AI3-15376 | Defender | M

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice,FedEx DG Service

Descripción general

2,4,6,8-Tetramethyl-1,3,5,7-Tetraoxacyclooctane is a compound that has been proposed as a potential pesticide
A compound that has been proposed as a potential pesticide

Specifications

Sinónimos

Blitzem | Metaldeide [Italian] | 1, 3, 5, 7-Tetroxocane, 2, 4, 6, 8-tetramethyl- | FT-0693272 | M0076 | HSDB 1735 | MFCD00134115 | Acetaldehyde Tetramer | Cekumeta | 2, 4, 6, 8-Tetramethyl-1, 3, 5, 7-tetraoxocane | Ariotox | Metacetaldehyde | AI3-15376 | Defender | M

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light

Enviado en

Wet ice, FedEx DG Service

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504753741
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753741
• Sonrisas canónicas: CC1OC(OC(OC(O1)C)C)C
• IUPAC Name: 2,4,6,8-tetramethyl-1,3,5,7-tetraoxocane
• InChIKey: GKKDCARASOJPNG-UHFFFAOYSA-N
• INCHI: 1S/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3
• Isómeros SMILES: CC1OC(OC(OC(O1)C)C)C
• RTECS: XF9900000
• CAS alternativo: 9002-91-9； 37273-91-9
• Número ONU: 1332
• Grupo de embalaje: III
• Peso molecular: 176.21
• Beilstein: 19(3/4)5643
• Reaxy-Rn: 107739
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107739&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Acetals
• Alternative Parents: Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oxacycle - Organoheterocyclic compound - Acetal - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as acetals. These are compounds having the structure R2C(OR')2 ( R' not Hydrogen) and thus diethers of geminal diols. Originally, the term was confined to derivatives of aldehydes (one R = H), but it now applies equally to derivatives of ketones (neither R = H ). Mixed acetals have different R' groups.
• External Descriptors: Molluscacide

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

Objetivos asociados (no humanos)

Brassica napus (1186 Activities)

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Arion subfuscus (12 Activities)

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Deroceras panormitanum (1 Activities)

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Deroceras reticulatum (16 Activities)

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Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Insoluble in water, water solubility: 0.02 w / W% (20 C), soluble in benzene and chloroform, slightly soluble in ethanol and ether.
• Sensibilidad: Light Sensitive,Heat Sensitive
• Punto de inflamación (°C): 55°C
• Punto de ebullición (°C): 65°C
• Punto de fusión (°C): 246°C
• Peso molecular: 176.210 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 176.105 Da
• Monoisotopic Mass: 176.105 Da
• Topological Polar Surface Area: 36.900 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 91.000
• 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

Referencias

1. Zhengyi Chen, Gongke Li, Zhuomin Zhang.  (2019)  Miniaturized array gas membrane separation strategy for rapid analysis of complex samples by surface-enhanced Raman scattering.  ANALYTICA CHIMICA ACTA,      [PMID:31005148] [10.1016/j.aca.2019.03.031]