Bis(trimethylsilyl) Malonate - ≥97%(GC) , CAS No.18457-04-0

CAS: 18457-04-0 Cat. No.: B151952 Peso molecular: 248.43 Beilstein Registry Number: 2212120 Número EC: 242-342-5

GRADE & PURITY ≥97%(GC)

Synonyms

F0001-0667 | trans-4-Hydroxy-beta-nitrostyrene | BIS(TRIMETHYLSILYL) MALONATE? | EINECS 242-342-5 | Malonic acid bis(trimethylsilyl ester) | J-011825 | bis(trimethylsilyl) propanedioate | BP-21139 | BS-42277 | malonic acid bis(trimethylsilylester) | Malon

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

F0001-0667 | trans-4-Hydroxy-beta-nitrostyrene | BIS(TRIMETHYLSILYL) MALONATE? | EINECS 242-342-5 | Malonic acid bis(trimethylsilyl ester) | J-011825 | bis(trimethylsilyl) propanedioate | BP-21139 | BS-42277 | malonic acid bis(trimethylsilylester) | Malon

Especificaciones y pureza

≥97%(GC)

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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Pureza

≥97%(GC)

Nombres e identificadores

• Sonrisas canónicas: C[Si](C)(C)OC(=O)CC(=O)O[Si](C)(C)C
• IUPAC Name: bis(trimethylsilyl) propanedioate
• InChIKey: ATCKJLDGNXGLAO-UHFFFAOYSA-N
• INCHI: 1S/C9H20O4Si2/c1-14(2,3)12-8(10)7-9(11)13-15(4,5)6/h7H2,1-6H3
• Isómeros SMILES: C[Si](C)(C)OC(=O)CC(=O)O[Si](C)(C)C
• WGK Alemania: 3
• Peso molecular: 248.43
• Beilstein: 2212120
• Reaxy-Rn: 2212115
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2212115&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Clase Organometalloid compounds
      • Subclass Organosilicon compounds

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Clase: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Trimethylsilyl esters
• Alternative Parents: Dicarboxylic acids and derivatives 1,3-dicarbonyl compounds Trialkylheterosilanes Carboxylic acid salts Organic metalloid salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trimethylsilyl ester - 1,3-dicarbonyl compound - Dicarboxylic acid or derivatives - Trialkylheterosilane - Carboxylic acid salt - Organoheterosilane - Organic metalloid salt - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as trimethylsilyl esters. These are organoheterosilanes, bearing a silicon atom that is linked to three methyl groups and is O-esterified.
• External Descriptors: Not available

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

Propiedades químicas y físicas

• Sensibilidad: Moisture Sensitive,Heat Sensitive
• Punto de inflamación (°F): 75.2 °F
• Punto de inflamación (°C): 24°C(lit.)
• Punto de ebullición (°C): 102°C/15mmHg(lit.)
• Peso molecular: 248.420 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 248.09 Da
• Monoisotopic Mass: 248.09 Da
• Topological Polar Surface Area: 52.600 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 224.000
• 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

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